3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine

C12H19N3 — CID 104973363

IUPAC3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine
SMILESCc1cccnc1NCC[C@@H]1CCCN1
InChIInChI=1S/C12H19N3/c1-10-4-2-8-14-12(10)15-9-6-11-5-3-7-13-11/h2,4,8,11,13H,3,5-7,9H2,1H3,(H,14,15)/t11-/m0/s1
InChIKeySJWCXGHMHULGQU-NSHDSACASA-N
MW205.31 g/mol
LogP1.94
Rot. Bonds4

About 3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine

3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine (PubChem CID 104973363) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine.

Molecular Properties

Compound Name3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine
PubChem CID104973363
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine
SMILESCc1cccnc1NCC[C@@H]1CCCN1
InChIInChI=1S/C12H19N3/c1-10-4-2-8-14-12(10)15-9-6-11-5-3-7-13-11/h2,4,8,11,13H,3,5-7,9H2,1H3,(H,14,15)/t11-/m0/s1
InChIKeySJWCXGHMHULGQU-NSHDSACASA-N
XLogP1.94
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-N-(2-piperidin-2-ylethyl)pyridin-2-amine
CID 83837474
3-bromo-4-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyridin-2-amine
CID 106876235
4-methyl-3-nitro-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyridin-2-amine
CID 104972861
3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine
CID 104973149
N-(2-pyrrolidin-2-ylethyl)thieno[3,2-c]pyridin-4-amine
CID 114794635
3-methyl-5-nitro-N-(2-pyrrolidin-2-ylethyl)pyridin-2-amine
CID 114794444
3-methyl-2-[2-[(2R)-pyrrolidin-2-yl]ethylamino]benzonitrile
CID 107111505
3-bromo-5-methyl-N-(2-pyrrolidin-2-ylethyl)pyridin-2-amine
CID 105367435
3-bromo-5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyridin-2-amine
CID 105367436
N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-1H-pyrrolo[2,3-b]pyridine-3-sulfonamide
CID 104972664
6-methoxy-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]isoquinolin-1-amine
CID 106541129
N-(2-pyrrolidin-2-ylethyl)-1H-pyrrolo[2,3-b]pyridine-3-sulfonamide
CID 114794123

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine?
The IUPAC name of 3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine (CID 104973363) is 3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine.
What is the SMILES notation for 3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine?
The canonical SMILES for 3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine is Cc1cccnc1NCC[C@@H]1CCCN1.
What is the InChIKey of 3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine?
The InChIKey is SJWCXGHMHULGQU-NSHDSACASA-N. The full InChI is InChI=1S/C12H19N3/c1-10-4-2-8-14-12(10)15-9-6-11-5-3-7-13-11/h2,4,8,11,13H,3,5-7,9H2,1H3,(H,14,15)/t11-/m0/s1.
What are the key properties of 3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine?
3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine has a molecular weight of 205.31 g/mol, XLogP of 1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyridin-2-amine is sourced from PubChem (CID 104973363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).