1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine

C15H29N3 — CID 55165550

IUPAC1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine
SMILESCCC1(CN2CCN(CC3CC3)CC2)CCNC1
InChIInChI=1S/C15H29N3/c1-2-15(5-6-16-12-15)13-18-9-7-17(8-10-18)11-14-3-4-14/h14,16H,2-13H2,1H3
InChIKeyDHZYROXMKIEACS-UHFFFAOYSA-N
MW251.42 g/mol
LogP1.40
Rot. Bonds5

About 1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine

1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine (PubChem CID 55165550) has the molecular formula C15H29N3 and a molecular weight of 251.42 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine
PubChem CID55165550
Molecular FormulaC15H29N3
Molecular Weight251.42 g/mol
Exact Mass251.24
IUPAC Name1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine
SMILESCCC1(CN2CCN(CC3CC3)CC2)CCNC1
InChIInChI=1S/C15H29N3/c1-2-15(5-6-16-12-15)13-18-9-7-17(8-10-18)11-14-3-4-14/h14,16H,2-13H2,1H3
InChIKeyDHZYROXMKIEACS-UHFFFAOYSA-N
XLogP1.40
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.42
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(3-ethylpyrrolidin-3-yl)methyl]-4-propylpiperazine
CID 55218735
1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine
CID 63979218
1-[(3-ethylpyrrolidin-3-yl)methyl]-3-pyrrolidin-1-ylpyrrolidine
CID 55224749
1-[(3-ethylpiperidin-3-yl)methyl]azocane
CID 55166633
1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine
CID 63129487
(2R,6S)-4-[(3-ethylpyrrolidin-3-yl)methyl]-2,6-dimethylmorpholine
CID 104959082
1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine
CID 102963677
1-[(3-ethylpyrrolidin-3-yl)methyl]-3,6-dihydro-2H-pyridine
CID 114410666
1-cyclopentyl-4-[(3-propylpyrrolidin-3-yl)methyl]piperazine
CID 63142665
2-ethyl-4-[(3-ethylpyrrolidin-3-yl)methyl]morpholine
CID 63142782
4-ethyl-1-[(3-ethylpiperidin-3-yl)methyl]-4-methylpiperidine
CID 63161620
2-[(3-ethylpyrrolidin-3-yl)methyl]-1,3-dihydroisoindole
CID 63143296

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine?
The IUPAC name of 1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine (CID 55165550) is 1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine.
What is the SMILES notation for 1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine?
The canonical SMILES for 1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine is CCC1(CN2CCN(CC3CC3)CC2)CCNC1.
What is the InChIKey of 1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine?
The InChIKey is DHZYROXMKIEACS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3/c1-2-15(5-6-16-12-15)13-18-9-7-17(8-10-18)11-14-3-4-14/h14,16H,2-13H2,1H3.
What are the key properties of 1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine?
1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine has a molecular weight of 251.42 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine is sourced from PubChem (CID 55165550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).