(2R)-2-(4-methylpiperidin-1-yl)butan-1-amine

C10H22N2 — CID 30081942

IUPAC(2R)-2-(4-methylpiperidin-1-yl)butan-1-amine
SMILESCC[C@H](CN)N1CCC(C)CC1
InChIInChI=1S/C10H22N2/c1-3-10(8-11)12-6-4-9(2)5-7-12/h9-10H,3-8,11H2,1-2H3/t10-/m1/s1
InChIKeyMPVDGJTZDIASNE-SNVBAGLBSA-N
MW170.30 g/mol
LogP1.46
Rot. Bonds3

About (2R)-2-(4-methylpiperidin-1-yl)butan-1-amine

(2R)-2-(4-methylpiperidin-1-yl)butan-1-amine (PubChem CID 30081942) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is (2R)-2-(4-methylpiperidin-1-yl)butan-1-amine.

Molecular Properties

Compound Name(2R)-2-(4-methylpiperidin-1-yl)butan-1-amine
PubChem CID30081942
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name(2R)-2-(4-methylpiperidin-1-yl)butan-1-amine
SMILESCC[C@H](CN)N1CCC(C)CC1
InChIInChI=1S/C10H22N2/c1-3-10(8-11)12-6-4-9(2)5-7-12/h9-10H,3-8,11H2,1-2H3/t10-/m1/s1
InChIKeyMPVDGJTZDIASNE-SNVBAGLBSA-N
XLogP1.46
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-methylpiperidin-1-yl)butan-1-amine?
The IUPAC name of (2R)-2-(4-methylpiperidin-1-yl)butan-1-amine (CID 30081942) is (2R)-2-(4-methylpiperidin-1-yl)butan-1-amine.
What is the SMILES notation for (2R)-2-(4-methylpiperidin-1-yl)butan-1-amine?
The canonical SMILES for (2R)-2-(4-methylpiperidin-1-yl)butan-1-amine is CC[C@H](CN)N1CCC(C)CC1.
What is the InChIKey of (2R)-2-(4-methylpiperidin-1-yl)butan-1-amine?
The InChIKey is MPVDGJTZDIASNE-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H22N2/c1-3-10(8-11)12-6-4-9(2)5-7-12/h9-10H,3-8,11H2,1-2H3/t10-/m1/s1.
What are the key properties of (2R)-2-(4-methylpiperidin-1-yl)butan-1-amine?
(2R)-2-(4-methylpiperidin-1-yl)butan-1-amine has a molecular weight of 170.30 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-methylpiperidin-1-yl)butan-1-amine is sourced from PubChem (CID 30081942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).