N-(piperidin-3-ylmethyl)pyrrol-1-amine

C10H17N3 — CID 80555534

IUPACN-(piperidin-3-ylmethyl)pyrrol-1-amine
SMILESc1ccn(NCC2CCCNC2)c1
InChIInChI=1S/C10H17N3/c1-2-7-13(6-1)12-9-10-4-3-5-11-8-10/h1-2,6-7,10-12H,3-5,8-9H2
InChIKeyDRJKGLNGTOLODZ-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.03
Rot. Bonds3

About N-(piperidin-3-ylmethyl)pyrrol-1-amine

N-(piperidin-3-ylmethyl)pyrrol-1-amine (PubChem CID 80555534) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is N-(piperidin-3-ylmethyl)pyrrol-1-amine.

Molecular Properties

Compound NameN-(piperidin-3-ylmethyl)pyrrol-1-amine
PubChem CID80555534
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC NameN-(piperidin-3-ylmethyl)pyrrol-1-amine
SMILESc1ccn(NCC2CCCNC2)c1
InChIInChI=1S/C10H17N3/c1-2-7-13(6-1)12-9-10-4-3-5-11-8-10/h1-2,6-7,10-12H,3-5,8-9H2
InChIKeyDRJKGLNGTOLODZ-UHFFFAOYSA-N
XLogP1.03
TPSA28.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-dimethyl-N-(piperidin-3-ylmethyl)piperidin-1-amine
CID 83006832
N-[[(3R)-piperidin-3-yl]methyl]ethanamine
CID 86317945
N-(piperidin-3-ylmethyl)-3-pyrazol-1-ylpropanamide;dihydrochloride
CID 119461176
N-(piperidin-3-ylmethyl)cyclododecanamine
CID 83958102
N-cyclopropylsulfanyl-1-piperidin-3-ylmethanamine
CID 170292773
N-(piperidin-3-ylmethyl)pyrrolidin-2-amine
CID 105440865
4-fluoro-N-(piperidin-3-ylmethyl)aniline
CID 79020016
(3S)-N-pyrrol-1-ylpiperidine-3-carboxamide
CID 81134103
N-(piperidin-3-ylmethyl)-2-pyrrolidin-1-ylaniline
CID 80553691
2-imidazol-1-yl-N-(piperidin-3-ylmethyl)ethanamine
CID 80555335
3-(piperidin-3-ylmethylamino)propan-1-ol
CID 80553574
N-cyclopropyl-2-(piperidin-3-ylmethylamino)acetamide
CID 80553600

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-3-ylmethyl)pyrrol-1-amine?
The IUPAC name of N-(piperidin-3-ylmethyl)pyrrol-1-amine (CID 80555534) is N-(piperidin-3-ylmethyl)pyrrol-1-amine.
What is the SMILES notation for N-(piperidin-3-ylmethyl)pyrrol-1-amine?
The canonical SMILES for N-(piperidin-3-ylmethyl)pyrrol-1-amine is c1ccn(NCC2CCCNC2)c1.
What is the InChIKey of N-(piperidin-3-ylmethyl)pyrrol-1-amine?
The InChIKey is DRJKGLNGTOLODZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-2-7-13(6-1)12-9-10-4-3-5-11-8-10/h1-2,6-7,10-12H,3-5,8-9H2.
What are the key properties of N-(piperidin-3-ylmethyl)pyrrol-1-amine?
N-(piperidin-3-ylmethyl)pyrrol-1-amine has a molecular weight of 179.27 g/mol, XLogP of 1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-3-ylmethyl)pyrrol-1-amine is sourced from PubChem (CID 80555534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).