N-methyl-N-[[(2S)-1-methylazetidin-2-yl]methyl]pyridin-3-amine

C11H17N3 — CID 10487961

IUPACN-methyl-N-[[(2S)-1-methylazetidin-2-yl]methyl]pyridin-3-amine
SMILESCN(C[C@@H]1CCN1C)c1cccnc1
InChIInChI=1S/C11H17N3/c1-13-7-5-11(13)9-14(2)10-4-3-6-12-8-10/h3-4,6,8,11H,5,7,9H2,1-2H3/t11-/m0/s1
InChIKeyAACGCHHFIBSAJH-NSHDSACASA-N
MW191.28 g/mol
LogP1.22
Rot. Bonds3

About N-methyl-N-[[(2S)-1-methylazetidin-2-yl]methyl]pyridin-3-amine

N-methyl-N-[[(2S)-1-methylazetidin-2-yl]methyl]pyridin-3-amine (PubChem CID 10487961) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is N-methyl-N-[[(2S)-1-methylazetidin-2-yl]methyl]pyridin-3-amine.

Molecular Properties

Compound NameN-methyl-N-[[(2S)-1-methylazetidin-2-yl]methyl]pyridin-3-amine
PubChem CID10487961
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC NameN-methyl-N-[[(2S)-1-methylazetidin-2-yl]methyl]pyridin-3-amine
SMILESCN(C[C@@H]1CCN1C)c1cccnc1
InChIInChI=1S/C11H17N3/c1-13-7-5-11(13)9-14(2)10-4-3-6-12-8-10/h3-4,6,8,11H,5,7,9H2,1-2H3/t11-/m0/s1
InChIKeyAACGCHHFIBSAJH-NSHDSACASA-N
XLogP1.22
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-[[(2S)-1-methylpiperidin-2-yl]methyl]aniline
CID 57253639
5-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]pyridine-2-carbonitrile
CID 113320651
5-bromo-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine
CID 104531843
N-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]pyridin-3-amine
CID 10750245
2-chloro-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-4-amine
CID 102824295
6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine
CID 103937477
N,N-dimethylmethanamine;3-[(2S)-1-methylpyrrolidin-2-yl]pyridine
CID 174560807
N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-4-(trifluoromethyl)aniline
CID 175854724
(1S)-1-[4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]phenyl]ethanol
CID 79318960
4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]pyridine-2-carbothioamide
CID 79313788
N-methyl-N-[2-(4-methylpiperazin-2-yl)ethyl]pyridin-3-amine
CID 115239388
N-methyl-N-(4-piperazin-1-ylbutyl)pyridin-3-amine
CID 115240359

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[(2S)-1-methylazetidin-2-yl]methyl]pyridin-3-amine?
The IUPAC name of N-methyl-N-[[(2S)-1-methylazetidin-2-yl]methyl]pyridin-3-amine (CID 10487961) is N-methyl-N-[[(2S)-1-methylazetidin-2-yl]methyl]pyridin-3-amine.
What is the SMILES notation for N-methyl-N-[[(2S)-1-methylazetidin-2-yl]methyl]pyridin-3-amine?
The canonical SMILES for N-methyl-N-[[(2S)-1-methylazetidin-2-yl]methyl]pyridin-3-amine is CN(C[C@@H]1CCN1C)c1cccnc1.
What is the InChIKey of N-methyl-N-[[(2S)-1-methylazetidin-2-yl]methyl]pyridin-3-amine?
The InChIKey is AACGCHHFIBSAJH-NSHDSACASA-N. The full InChI is InChI=1S/C11H17N3/c1-13-7-5-11(13)9-14(2)10-4-3-6-12-8-10/h3-4,6,8,11H,5,7,9H2,1-2H3/t11-/m0/s1.
What are the key properties of N-methyl-N-[[(2S)-1-methylazetidin-2-yl]methyl]pyridin-3-amine?
N-methyl-N-[[(2S)-1-methylazetidin-2-yl]methyl]pyridin-3-amine has a molecular weight of 191.28 g/mol, XLogP of 1.22, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[(2S)-1-methylazetidin-2-yl]methyl]pyridin-3-amine is sourced from PubChem (CID 10487961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).