N-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine

C15H24N4 — CID 81248115

IUPACN-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine
SMILESCNCc1cnccc1N1CCC(N2CCCC2)C1
InChIInChI=1S/C15H24N4/c1-16-10-13-11-17-6-4-15(13)19-9-5-14(12-19)18-7-2-3-8-18/h4,6,11,14,16H,2-3,5,7-10,12H2,1H3
InChIKeyUEMPTINREUAAQS-UHFFFAOYSA-N
MW260.38 g/mol
LogP1.48
Rot. Bonds4

About N-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine

N-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine (PubChem CID 81248115) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is N-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine
PubChem CID81248115
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC NameN-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine
SMILESCNCc1cnccc1N1CCC(N2CCCC2)C1
InChIInChI=1S/C15H24N4/c1-16-10-13-11-17-6-4-15(13)19-9-5-14(12-19)18-7-2-3-8-18/h4,6,11,14,16H,2-3,5,7-10,12H2,1H3
InChIKeyUEMPTINREUAAQS-UHFFFAOYSA-N
XLogP1.48
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-[4-(3-piperidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine
CID 81247363
N-[[4-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-3-pyridinyl]methyl]ethanamine
CID 81247402
1-[4-(4-tert-butylazepan-1-yl)-3-pyridinyl]-N-methylmethanamine
CID 81247515
1-[4-(3,5-dimethylpiperidin-1-yl)-3-pyridinyl]-N-methylmethanamine
CID 81249384
1-[2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)phenyl]-N-methylmethanamine
CID 79935349
1-[4-(2,5-dihydropyrrol-1-yl)-3-pyridinyl]-N-methylmethanamine
CID 130643019
1-[2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)phenyl]-N-methylmethanamine
CID 63150727
N-[[4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 81246723
N-methyl-1-[3-(4-methylpiperidin-1-yl)-4-pyridinyl]methanamine
CID 105072597
N-methyl-1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)-3-pyridinyl]methanamine
CID 81250152
1-[4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-3-pyridinyl]-N-methylmethanamine
CID 81246932
[3-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-4-pyridinyl]methanol
CID 105066917

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine?
The IUPAC name of N-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine (CID 81248115) is N-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine.
What is the SMILES notation for N-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine?
The canonical SMILES for N-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine is CNCc1cnccc1N1CCC(N2CCCC2)C1.
What is the InChIKey of N-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine?
The InChIKey is UEMPTINREUAAQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-16-10-13-11-17-6-4-15(13)19-9-5-14(12-19)18-7-2-3-8-18/h4,6,11,14,16H,2-3,5,7-10,12H2,1H3.
What are the key properties of N-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine?
N-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine has a molecular weight of 260.38 g/mol, XLogP of 1.48, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine is sourced from PubChem (CID 81248115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).