6-methyl-7-(4-propylpiperidin-1-yl)heptan-2-amine

C16H34N2 — CID 65295732

IUPAC6-methyl-7-(4-propylpiperidin-1-yl)heptan-2-amine
SMILESCCCC1CCN(CC(C)CCCC(C)N)CC1
InChIInChI=1S/C16H34N2/c1-4-6-16-9-11-18(12-10-16)13-14(2)7-5-8-15(3)17/h14-16H,4-13,17H2,1-3H3
InChIKeyVUSGIFGSDUVFRF-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.65
Rot. Bonds8

About 6-methyl-7-(4-propylpiperidin-1-yl)heptan-2-amine

6-methyl-7-(4-propylpiperidin-1-yl)heptan-2-amine (PubChem CID 65295732) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 6-methyl-7-(4-propylpiperidin-1-yl)heptan-2-amine.

Molecular Properties

Compound Name6-methyl-7-(4-propylpiperidin-1-yl)heptan-2-amine
PubChem CID65295732
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name6-methyl-7-(4-propylpiperidin-1-yl)heptan-2-amine
SMILESCCCC1CCN(CC(C)CCCC(C)N)CC1
InChIInChI=1S/C16H34N2/c1-4-6-16-9-11-18(12-10-16)13-14(2)7-5-8-15(3)17/h14-16H,4-13,17H2,1-3H3
InChIKeyVUSGIFGSDUVFRF-UHFFFAOYSA-N
XLogP3.65
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-4-(4-propylpiperidin-1-yl)butan-1-amine
CID 80544082
7-[3-(methoxymethyl)pyrrolidin-1-yl]-6-methylheptan-2-amine
CID 65296099
2-methyl-5-(4-propylpiperidin-1-yl)pentan-1-amine
CID 82016996
6-methyl-7-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)heptan-2-amine
CID 79170849
7-(4,4-dimethylazepan-1-yl)-6-methylheptan-2-amine
CID 65296260
6-methyl-7-(3-piperidin-1-ylpyrrolidin-1-yl)heptan-2-amine
CID 65296095
(3S)-1-(2-methylpentyl)pyrrolidin-3-amine
CID 115302330
1-(2-methylbutyl)-4-(3-methylpentyl)piperidine
CID 166678927
1-(2,2-difluoroethyl)-4-propylpiperidine
CID 89323946
1-(2,2-diethoxyethyl)-4-propylpiperidine
CID 63617165
4-methyl-5-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine
CID 103497584
2-methyl-3-(4-propylpiperidin-1-yl)propanethioamide
CID 62199637

Frequently Asked Questions

What is the IUPAC name of 6-methyl-7-(4-propylpiperidin-1-yl)heptan-2-amine?
The IUPAC name of 6-methyl-7-(4-propylpiperidin-1-yl)heptan-2-amine (CID 65295732) is 6-methyl-7-(4-propylpiperidin-1-yl)heptan-2-amine.
What is the SMILES notation for 6-methyl-7-(4-propylpiperidin-1-yl)heptan-2-amine?
The canonical SMILES for 6-methyl-7-(4-propylpiperidin-1-yl)heptan-2-amine is CCCC1CCN(CC(C)CCCC(C)N)CC1.
What is the InChIKey of 6-methyl-7-(4-propylpiperidin-1-yl)heptan-2-amine?
The InChIKey is VUSGIFGSDUVFRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-4-6-16-9-11-18(12-10-16)13-14(2)7-5-8-15(3)17/h14-16H,4-13,17H2,1-3H3.
What are the key properties of 6-methyl-7-(4-propylpiperidin-1-yl)heptan-2-amine?
6-methyl-7-(4-propylpiperidin-1-yl)heptan-2-amine has a molecular weight of 254.46 g/mol, XLogP of 3.65, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-7-(4-propylpiperidin-1-yl)heptan-2-amine is sourced from PubChem (CID 65295732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).