[5-(cyclopropylmethyl)-3,4-dihydro-2H-pyrrol-4-yl]methanamine

C9H16N2 — CID 163568043

IUPAC[5-(cyclopropylmethyl)-3,4-dihydro-2H-pyrrol-4-yl]methanamine
SMILESNCC1CCN=C1CC1CC1
InChIInChI=1S/C9H16N2/c10-6-8-3-4-11-9(8)5-7-1-2-7/h7-8H,1-6,10H2
InChIKeyFWWNVIZIWPHWOX-UHFFFAOYSA-N
MW152.24 g/mol
LogP1.21
Rot. Bonds3

About [5-(cyclopropylmethyl)-3,4-dihydro-2H-pyrrol-4-yl]methanamine

[5-(cyclopropylmethyl)-3,4-dihydro-2H-pyrrol-4-yl]methanamine (PubChem CID 163568043) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is [5-(cyclopropylmethyl)-3,4-dihydro-2H-pyrrol-4-yl]methanamine.

Molecular Properties

Compound Name[5-(cyclopropylmethyl)-3,4-dihydro-2H-pyrrol-4-yl]methanamine
PubChem CID163568043
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name[5-(cyclopropylmethyl)-3,4-dihydro-2H-pyrrol-4-yl]methanamine
SMILESNCC1CCN=C1CC1CC1
InChIInChI=1S/C9H16N2/c10-6-8-3-4-11-9(8)5-7-1-2-7/h7-8H,1-6,10H2
InChIKeyFWWNVIZIWPHWOX-UHFFFAOYSA-N
XLogP1.21
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(aminomethyl)cyclohexyl]methanamine
CID 158172497
2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine
CID 82408063
2,5-bis(aminomethyl)cyclohexan-1-one
CID 89427946
[4-(cyclopropylmethyl)furan-2-yl]methanamine
CID 96635997
[5-(cyclopropylmethyl)-1,2-oxazol-3-yl]methanamine;hydrochloride
CID 139022623
4-ethyl-5-methyl-3,4-dihydro-2H-pyrrole
CID 12791710
3-(cyclopropylmethyl)-1,2-oxazol-5-amine
CID 54776320
[(4S)-3,4-dihydro-2H-chromen-4-yl]methanamine
CID 51887495
[(4R)-3,4-dihydro-2H-chromen-4-yl]methanamine
CID 51887493
5-bromo-2-(cyclopropylmethyl)pyrimidine
CID 58368900
[2-(cyclopropylmethyl)-4-(2-methylpropyl)-1,3-thiazol-5-yl]methanamine
CID 114362179
3-[5-(cyclobutylmethyl)-1,3-oxazol-2-yl]propan-1-amine
CID 103167128

Frequently Asked Questions

What is the IUPAC name of [5-(cyclopropylmethyl)-3,4-dihydro-2H-pyrrol-4-yl]methanamine?
The IUPAC name of [5-(cyclopropylmethyl)-3,4-dihydro-2H-pyrrol-4-yl]methanamine (CID 163568043) is [5-(cyclopropylmethyl)-3,4-dihydro-2H-pyrrol-4-yl]methanamine.
What is the SMILES notation for [5-(cyclopropylmethyl)-3,4-dihydro-2H-pyrrol-4-yl]methanamine?
The canonical SMILES for [5-(cyclopropylmethyl)-3,4-dihydro-2H-pyrrol-4-yl]methanamine is NCC1CCN=C1CC1CC1.
What is the InChIKey of [5-(cyclopropylmethyl)-3,4-dihydro-2H-pyrrol-4-yl]methanamine?
The InChIKey is FWWNVIZIWPHWOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c10-6-8-3-4-11-9(8)5-7-1-2-7/h7-8H,1-6,10H2.
What are the key properties of [5-(cyclopropylmethyl)-3,4-dihydro-2H-pyrrol-4-yl]methanamine?
[5-(cyclopropylmethyl)-3,4-dihydro-2H-pyrrol-4-yl]methanamine has a molecular weight of 152.24 g/mol, XLogP of 1.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(cyclopropylmethyl)-3,4-dihydro-2H-pyrrol-4-yl]methanamine is sourced from PubChem (CID 163568043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).