N-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine

C14H22N4 — CID 104534506

IUPACN-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine
SMILESCNc1cncc(N2CCC(N3CCCC3)C2)c1
InChIInChI=1S/C14H22N4/c1-15-12-8-14(10-16-9-12)18-7-4-13(11-18)17-5-2-3-6-17/h8-10,13,15H,2-7,11H2,1H3
InChIKeyFVTYGXCHISULAZ-UHFFFAOYSA-N
MW246.36 g/mol
LogP1.80
Rot. Bonds3

About N-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine

N-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine (PubChem CID 104534506) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is N-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine.

Molecular Properties

Compound NameN-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine
PubChem CID104534506
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC NameN-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine
SMILESCNc1cncc(N2CCC(N3CCCC3)C2)c1
InChIInChI=1S/C14H22N4/c1-15-12-8-14(10-16-9-12)18-7-4-13(11-18)17-5-2-3-6-17/h8-10,13,15H,2-7,11H2,1H3
InChIKeyFVTYGXCHISULAZ-UHFFFAOYSA-N
XLogP1.80
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-1-[5-(methylamino)-3-pyridinyl]pyrrolidin-3-ol
CID 124569646
5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridin-3-amine
CID 113424017
5-(3-methoxypiperidin-1-yl)-N-methylpyridin-3-amine
CID 102971679
N-methyl-5-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)pyridin-3-amine
CID 104535461
2-(5-bromo-3-pyridinyl)-3,4,5,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a][1,4]diazepine
CID 114223219
methyl N-[1-[5-(methylamino)-3-pyridinyl]pyrrolidin-3-yl]carbamate
CID 113424237
N-methyl-5-(2-methylpiperidin-1-yl)pyridin-3-amine
CID 104532444
5-(2,6-dimethylmorpholin-4-yl)-N-methylpyridin-3-amine
CID 104532451
3-chloro-5-(3-piperidin-1-ylpyrrolidin-1-yl)pyridazine
CID 114478285
1-[5-[[5-chloro-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyrimidin-2-yl]amino]-3-pyridinyl]pyrrolidin-2-one
CID 171627124
5-(3-azaspiro[5.5]undecan-3-yl)-N-methylpyridin-3-amine
CID 104534385
N-methyl-1-[4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-3-pyridinyl]methanamine
CID 81248115

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine?
The IUPAC name of N-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine (CID 104534506) is N-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine.
What is the SMILES notation for N-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine?
The canonical SMILES for N-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine is CNc1cncc(N2CCC(N3CCCC3)C2)c1.
What is the InChIKey of N-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine?
The InChIKey is FVTYGXCHISULAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c1-15-12-8-14(10-16-9-12)18-7-4-13(11-18)17-5-2-3-6-17/h8-10,13,15H,2-7,11H2,1H3.
What are the key properties of N-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine?
N-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine has a molecular weight of 246.36 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridin-3-amine is sourced from PubChem (CID 104534506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).