4-(1-aminopropyl)-1H-pyrrol-2-amine

C7H13N3 — CID 130002522

IUPAC4-(1-aminopropyl)-1H-pyrrol-2-amine
SMILESCCC(N)c1c[nH]c(N)c1
InChIInChI=1S/C7H13N3/c1-2-6(8)5-3-7(9)10-4-5/h3-4,6,10H,2,8-9H2,1H3
InChIKeyDBROAMADIZECNX-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.01
Rot. Bonds2

About 4-(1-aminopropyl)-1H-pyrrol-2-amine

4-(1-aminopropyl)-1H-pyrrol-2-amine (PubChem CID 130002522) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is 4-(1-aminopropyl)-1H-pyrrol-2-amine.

Molecular Properties

Compound Name4-(1-aminopropyl)-1H-pyrrol-2-amine
PubChem CID130002522
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC Name4-(1-aminopropyl)-1H-pyrrol-2-amine
SMILESCCC(N)c1c[nH]c(N)c1
InChIInChI=1S/C7H13N3/c1-2-6(8)5-3-7(9)10-4-5/h3-4,6,10H,2,8-9H2,1H3
InChIKeyDBROAMADIZECNX-UHFFFAOYSA-N
XLogP1.01
TPSA67.83 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-amino-3-(5-amino-1H-pyrrol-3-yl)propanenitrile
CID 130971587
5-(1-aminopropyl)-3-methyl-1H-pyridine-2-thione
CID 102544993
(1S)-1-(5-methylsulfanyl-1H-pyrrol-3-yl)propan-1-amine;hydrochloride
CID 141264531
1-[3-(1-aminopropyl)phenyl]propan-1-amine
CID 20543882
1-(1H-pyrazol-4-yl)propan-1-amine
CID 62731706
1-(3,5-dibromophenyl)propan-1-amine
CID 91121714
5-[(1S)-1-aminopropyl]-2-bromoaniline
CID 130649492
(1S)-1-(3,4,5-trifluorophenyl)propan-1-amine
CID 55255857
(1S)-1-(2,6-dimethyl-4-pyridinyl)propan-1-amine
CID 107504745
5-(1-aminopropyl)-2-chloroaniline
CID 67750170
4-[(1R)-1-aminopropyl]pyridin-2-amine
CID 55274349
(1S)-1-phenylpropan-1-amine;hydrochloride
CID 44542268

Frequently Asked Questions

What is the IUPAC name of 4-(1-aminopropyl)-1H-pyrrol-2-amine?
The IUPAC name of 4-(1-aminopropyl)-1H-pyrrol-2-amine (CID 130002522) is 4-(1-aminopropyl)-1H-pyrrol-2-amine.
What is the SMILES notation for 4-(1-aminopropyl)-1H-pyrrol-2-amine?
The canonical SMILES for 4-(1-aminopropyl)-1H-pyrrol-2-amine is CCC(N)c1c[nH]c(N)c1.
What is the InChIKey of 4-(1-aminopropyl)-1H-pyrrol-2-amine?
The InChIKey is DBROAMADIZECNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3/c1-2-6(8)5-3-7(9)10-4-5/h3-4,6,10H,2,8-9H2,1H3.
What are the key properties of 4-(1-aminopropyl)-1H-pyrrol-2-amine?
4-(1-aminopropyl)-1H-pyrrol-2-amine has a molecular weight of 139.20 g/mol, XLogP of 1.01, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-aminopropyl)-1H-pyrrol-2-amine is sourced from PubChem (CID 130002522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).