(2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine

C9H20N2 — CID 95913690

IUPAC(2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine
SMILESCC(C)N[C@H]1CCN[C@@H](C)C1
InChIInChI=1S/C9H20N2/c1-7(2)11-9-4-5-10-8(3)6-9/h7-11H,4-6H2,1-3H3/t8-,9-/m0/s1
InChIKeyZHICUFZXGLQRJM-IUCAKERBSA-N
MW156.27 g/mol
LogP1.12
Rot. Bonds2

About (2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine

(2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine (PubChem CID 95913690) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is (2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine.

Molecular Properties

Compound Name(2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine
PubChem CID95913690
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name(2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine
SMILESCC(C)N[C@H]1CCN[C@@H](C)C1
InChIInChI=1S/C9H20N2/c1-7(2)11-9-4-5-10-8(3)6-9/h7-11H,4-6H2,1-3H3/t8-,9-/m0/s1
InChIKeyZHICUFZXGLQRJM-IUCAKERBSA-N
XLogP1.12
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-methylpiperidin-4-yl)-3-propan-2-ylurea
CID 106995611
2-(azepan-1-yl)-N-(2-methylpiperidin-4-yl)propanamide
CID 120600315
trans-(1S,3S)-3-methyl-N-propan-2-ylcyclopentan-1-amine
CID 58394445
(1R)-3-methyl-N-propan-2-ylcyclopentan-1-amine
CID 58394376
2-methoxy-N-(2-methylpiperidin-4-yl)propanamide
CID 106995606
(3R)-N-propan-2-ylpyrrolidin-3-amine
CID 53346611
[(2R,4R)-2-methylpiperidin-4-yl]carbamic acid
CID 146485805
2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide
CID 120601910
2-[(2-methylpiperidin-4-yl)amino]ethanol
CID 164646040
3-methyl-N-(2-methylpiperidin-4-yl)butane-1-sulfonamide
CID 106995821
(2R,4R)-2-methyl-4-propan-2-ylpiperidine
CID 96733113
4-methyl-1-N,3-N-di(propan-2-yl)cyclohexane-1,3-diamine
CID 137442853

Frequently Asked Questions

What is the IUPAC name of (2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine?
The IUPAC name of (2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine (CID 95913690) is (2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine.
What is the SMILES notation for (2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine?
The canonical SMILES for (2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine is CC(C)N[C@H]1CCN[C@@H](C)C1.
What is the InChIKey of (2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine?
The InChIKey is ZHICUFZXGLQRJM-IUCAKERBSA-N. The full InChI is InChI=1S/C9H20N2/c1-7(2)11-9-4-5-10-8(3)6-9/h7-11H,4-6H2,1-3H3/t8-,9-/m0/s1.
What are the key properties of (2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine?
(2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine has a molecular weight of 156.27 g/mol, XLogP of 1.12, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine is sourced from PubChem (CID 95913690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).