(1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine

C14H22N2 — CID 67869065

IUPAC(1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine
SMILESCN[C@@H](c1ccccc1)[C@@H]1CCCCN1C
InChIInChI=1S/C14H22N2/c1-15-14(12-8-4-3-5-9-12)13-10-6-7-11-16(13)2/h3-5,8-9,13-15H,6-7,10-11H2,1-2H3/t13-,14-/m0/s1
InChIKeyTWKGZTCZTZOZIJ-KBPBESRZSA-N
MW218.34 g/mol
LogP2.43
Rot. Bonds3

About (1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine

(1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine (PubChem CID 67869065) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is (1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine.

Molecular Properties

Compound Name(1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine
PubChem CID67869065
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name(1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine
SMILESCN[C@@H](c1ccccc1)[C@@H]1CCCCN1C
InChIInChI=1S/C14H22N2/c1-15-14(12-8-4-3-5-9-12)13-10-6-7-11-16(13)2/h3-5,8-9,13-15H,6-7,10-11H2,1-2H3/t13-,14-/m0/s1
InChIKeyTWKGZTCZTZOZIJ-KBPBESRZSA-N
XLogP2.43
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(2S)-1-methylpiperidin-2-yl]-phenylmethanol
CID 67164631
N-methyl-1-(1-methylpiperazin-2-yl)-1-phenylmethanamine
CID 116956619
2-benzhydryl-1-methylpyrrolidine
CID 71178925
4-amino-3,5-dichloro-N-[(R)-[(2R)-1-methylpiperidin-2-yl]-phenylmethyl]benzamide;hydrochloride
CID 67165144
2,3-dichloro-N-[(S)-[(2S)-1-methylazepan-2-yl]-phenylmethyl]benzamide
CID 129152159
2,5-dichloro-N-[(S)-[(2S)-1-methylpiperidin-2-yl]-phenylmethyl]thiophene-3-carboxamide
CID 11339141
3-[(S)-[(2S)-1-methylpiperidin-2-yl]-phenylmethyl]phenol
CID 129360203
4-amino-3,3,5,5-tetrachloro-N-[(R)-[(2R)-1-methylpiperidin-2-yl]-phenylmethyl]cyclohexene-1-carboxamide
CID 67165228
4-amino-3-chloro-N-[(1-methylpiperidin-2-yl)-phenylmethyl]-5-(trifluoromethyl)benzamide
CID 69104804
1-(1H-indazol-6-yl)-3-[[(2S)-1-methylpiperidin-2-yl]-phenylmethyl]urea
CID 25153813
3-iodo-5-[[(1-methylpiperidin-2-yl)-phenylmethyl]carbamoylamino]indazole-1-carboxylic acid
CID 68726088
N-methyl-1-(oxan-2-yl)-1-phenylmethanamine
CID 62213165

Frequently Asked Questions

What is the IUPAC name of (1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine?
The IUPAC name of (1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine (CID 67869065) is (1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine.
What is the SMILES notation for (1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine?
The canonical SMILES for (1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine is CN[C@@H](c1ccccc1)[C@@H]1CCCCN1C.
What is the InChIKey of (1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine?
The InChIKey is TWKGZTCZTZOZIJ-KBPBESRZSA-N. The full InChI is InChI=1S/C14H22N2/c1-15-14(12-8-4-3-5-9-12)13-10-6-7-11-16(13)2/h3-5,8-9,13-15H,6-7,10-11H2,1-2H3/t13-,14-/m0/s1.
What are the key properties of (1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine?
(1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine has a molecular weight of 218.34 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-N-methyl-1-[(2S)-1-methylpiperidin-2-yl]-1-phenylmethanamine is sourced from PubChem (CID 67869065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).