N-heptan-4-yl-N-methylpiperidin-3-amine

C13H28N2 — CID 63644400

IUPACN-heptan-4-yl-N-methylpiperidin-3-amine
SMILESCCCC(CCC)N(C)C1CCCNC1
InChIInChI=1S/C13H28N2/c1-4-7-12(8-5-2)15(3)13-9-6-10-14-11-13/h12-14H,4-11H2,1-3H3
InChIKeyVSLZOUQNXSRPEN-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.64
Rot. Bonds6

About N-heptan-4-yl-N-methylpiperidin-3-amine

N-heptan-4-yl-N-methylpiperidin-3-amine (PubChem CID 63644400) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N-heptan-4-yl-N-methylpiperidin-3-amine.

Molecular Properties

Compound NameN-heptan-4-yl-N-methylpiperidin-3-amine
PubChem CID63644400
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN-heptan-4-yl-N-methylpiperidin-3-amine
SMILESCCCC(CCC)N(C)C1CCCNC1
InChIInChI=1S/C13H28N2/c1-4-7-12(8-5-2)15(3)13-9-6-10-14-11-13/h12-14H,4-11H2,1-3H3
InChIKeyVSLZOUQNXSRPEN-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-N-methyl-N-propan-2-ylpiperidin-3-amine;dihydrochloride
CID 135207468
N,2-dimethyl-N-piperidin-3-ylpentanamide
CID 60806895
2-[methyl(piperidin-3-yl)amino]butanamide
CID 63643022
N-[1-(4-bromophenyl)ethyl]-N-methylpiperidin-3-amine
CID 63641916
N,N-diethyl-2-[methyl(piperidin-3-yl)amino]propanamide
CID 55248539
N-ethyl-N-(piperidin-3-ylmethyl)heptan-4-amine
CID 106624422
N-(1-methoxypropan-2-yl)-N-methylazepan-3-amine
CID 62642462
2-[methyl(pyrrolidin-3-yl)amino]pentanoic acid
CID 83049954
1-fluorobutyl(piperidin-3-yl)carbamic acid
CID 146368395
ethyl 2-[azepan-4-yl(methyl)amino]pentanoate
CID 107173439
N-methyl-N-(2-methylpropyl)piperidin-3-amine
CID 43317078
N-ethyl-N-propylpiperidin-3-amine
CID 43317075

Frequently Asked Questions

What is the IUPAC name of N-heptan-4-yl-N-methylpiperidin-3-amine?
The IUPAC name of N-heptan-4-yl-N-methylpiperidin-3-amine (CID 63644400) is N-heptan-4-yl-N-methylpiperidin-3-amine.
What is the SMILES notation for N-heptan-4-yl-N-methylpiperidin-3-amine?
The canonical SMILES for N-heptan-4-yl-N-methylpiperidin-3-amine is CCCC(CCC)N(C)C1CCCNC1.
What is the InChIKey of N-heptan-4-yl-N-methylpiperidin-3-amine?
The InChIKey is VSLZOUQNXSRPEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-4-7-12(8-5-2)15(3)13-9-6-10-14-11-13/h12-14H,4-11H2,1-3H3.
What are the key properties of N-heptan-4-yl-N-methylpiperidin-3-amine?
N-heptan-4-yl-N-methylpiperidin-3-amine has a molecular weight of 212.38 g/mol, XLogP of 2.64, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-heptan-4-yl-N-methylpiperidin-3-amine is sourced from PubChem (CID 63644400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).