N-(1H-pyrrol-3-yl)piperidin-3-amine

C9H15N3 — CID 83695048

IUPACN-(1H-pyrrol-3-yl)piperidin-3-amine
SMILESc1cc(NC2CCCNC2)c[nH]1
InChIInChI=1S/C9H15N3/c1-2-8(6-10-4-1)12-9-3-5-11-7-9/h3,5,7-8,10-12H,1-2,4,6H2
InChIKeyQJQABCUCKWYYCS-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.18
Rot. Bonds2

About N-(1H-pyrrol-3-yl)piperidin-3-amine

N-(1H-pyrrol-3-yl)piperidin-3-amine (PubChem CID 83695048) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is N-(1H-pyrrol-3-yl)piperidin-3-amine.

Molecular Properties

Compound NameN-(1H-pyrrol-3-yl)piperidin-3-amine
PubChem CID83695048
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC NameN-(1H-pyrrol-3-yl)piperidin-3-amine
SMILESc1cc(NC2CCCNC2)c[nH]1
InChIInChI=1S/C9H15N3/c1-2-8(6-10-4-1)12-9-3-5-11-7-9/h3,5,7-8,10-12H,1-2,4,6H2
InChIKeyQJQABCUCKWYYCS-UHFFFAOYSA-N
XLogP1.18
TPSA39.85 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-pyrrolidin-3-yl-1H-pyrrol-3-amine
CID 115118616
(3R)-N-(4-bromophenyl)piperidin-3-amine
CID 167150993
N-(4-chloro-3-methoxyphenyl)piperidin-3-amine
CID 107621326
N-(2,4,5-trifluorophenyl)piperidin-3-amine
CID 62814853
N-[4-(5-amino-1H-pyrazol-4-yl)phenyl]piperidin-3-amine
CID 141333654
5-(piperidin-3-ylamino)pyridine-2-carbonitrile
CID 115490388
N-piperidin-3-yl-2-propan-2-ylpyridin-4-amine
CID 83837395
6-chloro-N-piperidin-3-ylpyridin-2-amine
CID 71564691
N-piperidin-3-ylpyridin-2-amine
CID 63321128
N-methyl-4-(piperidin-3-ylamino)pyridine-2-carboxamide
CID 63319202
N-(2,5-dimethylpyrrol-1-yl)piperidin-3-amine
CID 79100377
N-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine
CID 116970983

Frequently Asked Questions

What is the IUPAC name of N-(1H-pyrrol-3-yl)piperidin-3-amine?
The IUPAC name of N-(1H-pyrrol-3-yl)piperidin-3-amine (CID 83695048) is N-(1H-pyrrol-3-yl)piperidin-3-amine.
What is the SMILES notation for N-(1H-pyrrol-3-yl)piperidin-3-amine?
The canonical SMILES for N-(1H-pyrrol-3-yl)piperidin-3-amine is c1cc(NC2CCCNC2)c[nH]1.
What is the InChIKey of N-(1H-pyrrol-3-yl)piperidin-3-amine?
The InChIKey is QJQABCUCKWYYCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-2-8(6-10-4-1)12-9-3-5-11-7-9/h3,5,7-8,10-12H,1-2,4,6H2.
What are the key properties of N-(1H-pyrrol-3-yl)piperidin-3-amine?
N-(1H-pyrrol-3-yl)piperidin-3-amine has a molecular weight of 165.24 g/mol, XLogP of 1.18, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-pyrrol-3-yl)piperidin-3-amine is sourced from PubChem (CID 83695048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).