N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine

C16H24N4 — CID 82824696

IUPACN-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
SMILESc1cnc(N2CCCC2)c(NC2CCN3CCCC23)c1
InChIInChI=1S/C16H24N4/c1-2-10-20(9-1)16-14(5-3-8-17-16)18-13-7-12-19-11-4-6-15(13)19/h3,5,8,13,15,18H,1-2,4,6-7,9-12H2
InChIKeyYEAYYWVPQKUKAD-UHFFFAOYSA-N
MW272.40 g/mol
LogP2.33
Rot. Bonds3

About N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine

N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine (PubChem CID 82824696) has the molecular formula C16H24N4 and a molecular weight of 272.40 g/mol. Its IUPAC name is N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine.

Molecular Properties

Compound NameN-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
PubChem CID82824696
Molecular FormulaC16H24N4
Molecular Weight272.40 g/mol
Exact Mass272.20
IUPAC NameN-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
SMILESc1cnc(N2CCCC2)c(NC2CCN3CCCC23)c1
InChIInChI=1S/C16H24N4/c1-2-10-20(9-1)16-14(5-3-8-17-16)18-13-7-12-19-11-4-6-15(13)19/h3,5,8,13,15,18H,1-2,4,6-7,9-12H2
InChIKeyYEAYYWVPQKUKAD-UHFFFAOYSA-N
XLogP2.33
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.40
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine with MolForge

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Related Compounds

N-(2-methyloxolan-3-yl)-2-pyrrolidin-1-ylpyridin-3-amine
CID 82727361
N-(3-methylcyclopentyl)-2-pyrrolidin-1-ylpyridin-3-amine
CID 64500200
N-(oxan-4-yl)-2-pyrrolidin-1-ylpyridin-3-amine
CID 43676380
2-pyrrolidin-1-yl-N-(thian-4-yl)pyridin-3-amine
CID 43676508
N-naphthalen-1-yl-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 82853527
N-pyridazin-3-yl-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 62482243
N-(2-pyrrolidin-1-yl-3-pyridinyl)azepan-4-amine
CID 103981032
1-N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)-2-N,2-N-dimethylbenzene-1,2-diamine
CID 82853207
N-(2-ethoxyphenyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 82854063
N-(3-chloro-2-imidazol-1-ylphenyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 82824103
N-(3-bromo-2-methylphenyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 103892794
N-(2-propylphenyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 82853541

Frequently Asked Questions

What is the IUPAC name of N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine?
The IUPAC name of N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine (CID 82824696) is N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine.
What is the SMILES notation for N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine?
The canonical SMILES for N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine is c1cnc(N2CCCC2)c(NC2CCN3CCCC23)c1.
What is the InChIKey of N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine?
The InChIKey is YEAYYWVPQKUKAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4/c1-2-10-20(9-1)16-14(5-3-8-17-16)18-13-7-12-19-11-4-6-15(13)19/h3,5,8,13,15,18H,1-2,4,6-7,9-12H2.
What are the key properties of N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine?
N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine has a molecular weight of 272.40 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyrrolidin-1-yl-3-pyridinyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine is sourced from PubChem (CID 82824696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).