1-methyl-4-[(1-methyl-3,4-dihydro-2H-cyclopenta[b]pyrrol-4-yl)methyl]-3,4-dihydro-2H-cyclopenta[b]pyrrole

C17H22N2 — CID 175638150

IUPAC1-methyl-4-[(1-methyl-3,4-dihydro-2H-cyclopenta[b]pyrrol-4-yl)methyl]-3,4-dihydro-2H-cyclopenta[b]pyrrole
SMILESCN1CCC2=C1C=CC2CC1C=CC2=C1CCN2C
InChIInChI=1S/C17H22N2/c1-18-9-7-14-12(3-5-16(14)18)11-13-4-6-17-15(13)8-10-19(17)2/h3-6,12-13H,7-11H2,1-2H3
InChIKeyATIZRAHKPJRAHR-UHFFFAOYSA-N
MW254.38 g/mol
LogP2.93
Rot. Bonds2

About 1-methyl-4-[(1-methyl-3,4-dihydro-2H-cyclopenta[b]pyrrol-4-yl)methyl]-3,4-dihydro-2H-cyclopenta[b]pyrrole

1-methyl-4-[(1-methyl-3,4-dihydro-2H-cyclopenta[b]pyrrol-4-yl)methyl]-3,4-dihydro-2H-cyclopenta[b]pyrrole (PubChem CID 175638150) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is 1-methyl-4-[(1-methyl-3,4-dihydro-2H-cyclopenta[b]pyrrol-4-yl)methyl]-3,4-dihydro-2H-cyclopenta[b]pyrrole.

Molecular Properties

Compound Name1-methyl-4-[(1-methyl-3,4-dihydro-2H-cyclopenta[b]pyrrol-4-yl)methyl]-3,4-dihydro-2H-cyclopenta[b]pyrrole
PubChem CID175638150
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC Name1-methyl-4-[(1-methyl-3,4-dihydro-2H-cyclopenta[b]pyrrol-4-yl)methyl]-3,4-dihydro-2H-cyclopenta[b]pyrrole
SMILESCN1CCC2=C1C=CC2CC1C=CC2=C1CCN2C
InChIInChI=1S/C17H22N2/c1-18-9-7-14-12(3-5-16(14)18)11-13-4-6-17-15(13)8-10-19(17)2/h3-6,12-13H,7-11H2,1-2H3
InChIKeyATIZRAHKPJRAHR-UHFFFAOYSA-N
XLogP2.93
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 139162238
N,N,2,3,4,5,6-heptamethyl-2,3-dihydropentalen-1-amine;(E,3E)-N,N,2-trimethyl-3-(2,3,4-trimethylcyclopenta-2,4-dien-1-ylidene)but-1-en-1-amine
CID 53968278
2,5-bis(ethenyl)-1-[(5Z,9Z,11Z)-11-methyltetradeca-1,5,9,11,13-pentaen-3-yl]-3,4-dipropyl-2,3-dihydropyrrole
CID 89223612
(3aS,6R,11aS)-3-ethenyl-1,6-dimethyl-2-[(Z)-prop-1-enyl]-3a,4,5,6,7,8,9,10,11,11a-decahydrocyclodeca[b]pyrrole
CID 118506980
(2Z,4E)-N-(5-cyclooctylpentyl)-N-methyl-5-[(Z)-prop-1-enyl]undeca-2,4-dien-4-amine
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4-ethenyl-2-[[3-ethenyl-4-[(Z)-prop-1-enyl]cyclopent-3-en-1-yl]methyl]-1,3-dimethyl-5-[(Z)-prop-1-enyl]-2,3-dihydropyrrole
CID 134188149
2-[3-[(1Z)-buta-1,3-dienyl]-4-ethenylcyclohex-3-en-1-yl]-4-ethenyl-3-ethyl-1-methyl-5-[(Z)-prop-1-enyl]-2,3-dihydropyrrole
CID 134188176
3-[[3-[(1Z)-buta-1,3-dienyl]-2-ethenyl-5-ethylcyclopent-2-en-1-yl]methyl]-4-ethenyl-1,2-dimethyl-5-[(Z)-prop-1-enyl]-2,3-dihydropyrrole
CID 137382550
1-(2-ethenyl-6-propan-2-ylnonyl)-4-methyl-5-methylidene-3-[(Z)-prop-1-enyl]-2H-pyrrole
CID 137439439
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CID 142581446
N,N',3,7-tetramethyl-N-(4-methylcyclohexa-1,3-dien-1-yl)-N'-[(3Z)-5-methylhexa-1,3,5-trien-2-yl]nonane-1,9-diamine
CID 144942660
1,2,4-trimethyl-3-propan-2-yl-4a,5-dihydro-1H-cyclopenta[b]indole
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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-[(1-methyl-3,4-dihydro-2H-cyclopenta[b]pyrrol-4-yl)methyl]-3,4-dihydro-2H-cyclopenta[b]pyrrole?
The IUPAC name of 1-methyl-4-[(1-methyl-3,4-dihydro-2H-cyclopenta[b]pyrrol-4-yl)methyl]-3,4-dihydro-2H-cyclopenta[b]pyrrole (CID 175638150) is 1-methyl-4-[(1-methyl-3,4-dihydro-2H-cyclopenta[b]pyrrol-4-yl)methyl]-3,4-dihydro-2H-cyclopenta[b]pyrrole.
What is the SMILES notation for 1-methyl-4-[(1-methyl-3,4-dihydro-2H-cyclopenta[b]pyrrol-4-yl)methyl]-3,4-dihydro-2H-cyclopenta[b]pyrrole?
The canonical SMILES for 1-methyl-4-[(1-methyl-3,4-dihydro-2H-cyclopenta[b]pyrrol-4-yl)methyl]-3,4-dihydro-2H-cyclopenta[b]pyrrole is CN1CCC2=C1C=CC2CC1C=CC2=C1CCN2C.
What is the InChIKey of 1-methyl-4-[(1-methyl-3,4-dihydro-2H-cyclopenta[b]pyrrol-4-yl)methyl]-3,4-dihydro-2H-cyclopenta[b]pyrrole?
The InChIKey is ATIZRAHKPJRAHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-18-9-7-14-12(3-5-16(14)18)11-13-4-6-17-15(13)8-10-19(17)2/h3-6,12-13H,7-11H2,1-2H3.
What are the key properties of 1-methyl-4-[(1-methyl-3,4-dihydro-2H-cyclopenta[b]pyrrol-4-yl)methyl]-3,4-dihydro-2H-cyclopenta[b]pyrrole?
1-methyl-4-[(1-methyl-3,4-dihydro-2H-cyclopenta[b]pyrrol-4-yl)methyl]-3,4-dihydro-2H-cyclopenta[b]pyrrole has a molecular weight of 254.38 g/mol, XLogP of 2.93, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-[(1-methyl-3,4-dihydro-2H-cyclopenta[b]pyrrol-4-yl)methyl]-3,4-dihydro-2H-cyclopenta[b]pyrrole is sourced from PubChem (CID 175638150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).