N,4-dimethyl-N-[(2-methylpiperidin-4-yl)methyl]pentan-2-amine

C14H30N2 — CID 106740989

IUPACN,4-dimethyl-N-[(2-methylpiperidin-4-yl)methyl]pentan-2-amine
SMILESCC(C)CC(C)N(C)CC1CCNC(C)C1
InChIInChI=1S/C14H30N2/c1-11(2)8-13(4)16(5)10-14-6-7-15-12(3)9-14/h11-15H,6-10H2,1-5H3
InChIKeyNJKZGMNLMVOZRT-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.74
Rot. Bonds5

About N,4-dimethyl-N-[(2-methylpiperidin-4-yl)methyl]pentan-2-amine

N,4-dimethyl-N-[(2-methylpiperidin-4-yl)methyl]pentan-2-amine (PubChem CID 106740989) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is N,4-dimethyl-N-[(2-methylpiperidin-4-yl)methyl]pentan-2-amine.

Molecular Properties

Compound NameN,4-dimethyl-N-[(2-methylpiperidin-4-yl)methyl]pentan-2-amine
PubChem CID106740989
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC NameN,4-dimethyl-N-[(2-methylpiperidin-4-yl)methyl]pentan-2-amine
SMILESCC(C)CC(C)N(C)CC1CCNC(C)C1
InChIInChI=1S/C14H30N2/c1-11(2)8-13(4)16(5)10-14-6-7-15-12(3)9-14/h11-15H,6-10H2,1-5H3
InChIKeyNJKZGMNLMVOZRT-UHFFFAOYSA-N
XLogP2.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-N-[(2-methylpiperidin-4-yl)methyl]pentan-2-amine?
The IUPAC name of N,4-dimethyl-N-[(2-methylpiperidin-4-yl)methyl]pentan-2-amine (CID 106740989) is N,4-dimethyl-N-[(2-methylpiperidin-4-yl)methyl]pentan-2-amine.
What is the SMILES notation for N,4-dimethyl-N-[(2-methylpiperidin-4-yl)methyl]pentan-2-amine?
The canonical SMILES for N,4-dimethyl-N-[(2-methylpiperidin-4-yl)methyl]pentan-2-amine is CC(C)CC(C)N(C)CC1CCNC(C)C1.
What is the InChIKey of N,4-dimethyl-N-[(2-methylpiperidin-4-yl)methyl]pentan-2-amine?
The InChIKey is NJKZGMNLMVOZRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-11(2)8-13(4)16(5)10-14-6-7-15-12(3)9-14/h11-15H,6-10H2,1-5H3.
What are the key properties of N,4-dimethyl-N-[(2-methylpiperidin-4-yl)methyl]pentan-2-amine?
N,4-dimethyl-N-[(2-methylpiperidin-4-yl)methyl]pentan-2-amine has a molecular weight of 226.41 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-N-[(2-methylpiperidin-4-yl)methyl]pentan-2-amine is sourced from PubChem (CID 106740989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).