3-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine

C15H24N4 — CID 55157982

IUPAC3-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine
SMILESNc1ncccc1CN1CCC(N2CCCCC2)C1
InChIInChI=1S/C15H24N4/c16-15-13(5-4-7-17-15)11-18-10-6-14(12-18)19-8-2-1-3-9-19/h4-5,7,14H,1-3,6,8-12H2,(H2,16,17)
InChIKeyJKVOEJSZMQEGLS-UHFFFAOYSA-N
MW260.38 g/mol
LogP1.72
Rot. Bonds3

About 3-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine

3-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine (PubChem CID 55157982) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is 3-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine
PubChem CID55157982
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC Name3-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine
SMILESNc1ncccc1CN1CCC(N2CCCCC2)C1
InChIInChI=1S/C15H24N4/c16-15-13(5-4-7-17-15)11-18-10-6-14(12-18)19-8-2-1-3-9-19/h4-5,7,14H,1-3,6,8-12H2,(H2,16,17)
InChIKeyJKVOEJSZMQEGLS-UHFFFAOYSA-N
XLogP1.72
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)pyridin-2-amine
CID 79945516
3-(piperidin-1-ylmethyl)pyridin-2-amine
CID 18771814
N-methyl-3-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine
CID 63165530
3-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine-2-carbonitrile
CID 63169618
3-(pyrrolidin-1-ylmethyl)pyridin-2-amine
CID 62470567
3-[[4-[4-(aminomethyl)triazol-1-yl]piperidin-1-yl]methyl]pyridin-2-amine
CID 30956686
2-amino-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]benzoic acid
CID 104824671
8-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)quinoline
CID 78945122
3-bromo-4-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]aniline
CID 63171631
4-chloro-2-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]aniline
CID 79583365
3-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-ylmethyl)pyridine-2-carboxylic acid
CID 63151802
3-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-ylmethyl)pyridine-2-carboximidamide
CID 79932125

Frequently Asked Questions

What is the IUPAC name of 3-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine?
The IUPAC name of 3-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine (CID 55157982) is 3-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 3-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine?
The canonical SMILES for 3-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine is Nc1ncccc1CN1CCC(N2CCCCC2)C1.
What is the InChIKey of 3-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine?
The InChIKey is JKVOEJSZMQEGLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c16-15-13(5-4-7-17-15)11-18-10-6-14(12-18)19-8-2-1-3-9-19/h4-5,7,14H,1-3,6,8-12H2,(H2,16,17).
What are the key properties of 3-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine?
3-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine has a molecular weight of 260.38 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-piperidin-1-ylpyrrolidin-1-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 55157982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).