N,2-dimethyl-2-piperidin-1-ylheptan-3-amine

C14H30N2 — CID 79045929

IUPACN,2-dimethyl-2-piperidin-1-ylheptan-3-amine
SMILESCCCCC(NC)C(C)(C)N1CCCCC1
InChIInChI=1S/C14H30N2/c1-5-6-10-13(15-4)14(2,3)16-11-8-7-9-12-16/h13,15H,5-12H2,1-4H3
InChIKeyLLUPGDPKXRRETG-UHFFFAOYSA-N
MW226.41 g/mol
LogP3.03
Rot. Bonds6

About N,2-dimethyl-2-piperidin-1-ylheptan-3-amine

N,2-dimethyl-2-piperidin-1-ylheptan-3-amine (PubChem CID 79045929) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is N,2-dimethyl-2-piperidin-1-ylheptan-3-amine.

Molecular Properties

Compound NameN,2-dimethyl-2-piperidin-1-ylheptan-3-amine
PubChem CID79045929
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC NameN,2-dimethyl-2-piperidin-1-ylheptan-3-amine
SMILESCCCCC(NC)C(C)(C)N1CCCCC1
InChIInChI=1S/C14H30N2/c1-5-6-10-13(15-4)14(2,3)16-11-8-7-9-12-16/h13,15H,5-12H2,1-4H3
InChIKeyLLUPGDPKXRRETG-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(azepan-1-yl)-N,2,7-trimethyloctan-3-amine
CID 83161902
N,2,7-trimethyl-2-piperidin-1-yloctan-3-amine
CID 83161164
2-(azepan-1-yl)-N,2,6,6-tetramethylheptan-3-amine
CID 79052542
N-ethyl-2-methyl-2-piperidin-1-yloctan-3-amine
CID 79045571
N,2,5-trimethyl-2-piperidin-1-yloctan-3-amine
CID 79045179
2-(azepan-1-yl)-N,2-dimethylhept-6-en-3-amine
CID 79050662
N,3-dimethyl-3-pyrrolidin-1-yltridecan-4-amine
CID 79059306
(5-ethyl-2-methyl-2-pyrrolidin-1-ylnonan-3-yl)hydrazine
CID 105239546
(3-methyl-3-piperidin-1-yloctan-4-yl)hydrazine
CID 105241246
3-(azepan-1-yl)-1-cyclobutyl-N,3-dimethylbutan-2-amine
CID 79050954
1-cyclopentyl-N,3-dimethyl-3-piperidin-1-ylbutan-2-amine
CID 79045410
2-methyl-2-piperidin-1-ylhexan-3-ol
CID 79045077

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-2-piperidin-1-ylheptan-3-amine?
The IUPAC name of N,2-dimethyl-2-piperidin-1-ylheptan-3-amine (CID 79045929) is N,2-dimethyl-2-piperidin-1-ylheptan-3-amine.
What is the SMILES notation for N,2-dimethyl-2-piperidin-1-ylheptan-3-amine?
The canonical SMILES for N,2-dimethyl-2-piperidin-1-ylheptan-3-amine is CCCCC(NC)C(C)(C)N1CCCCC1.
What is the InChIKey of N,2-dimethyl-2-piperidin-1-ylheptan-3-amine?
The InChIKey is LLUPGDPKXRRETG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-5-6-10-13(15-4)14(2,3)16-11-8-7-9-12-16/h13,15H,5-12H2,1-4H3.
What are the key properties of N,2-dimethyl-2-piperidin-1-ylheptan-3-amine?
N,2-dimethyl-2-piperidin-1-ylheptan-3-amine has a molecular weight of 226.41 g/mol, XLogP of 3.03, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-2-piperidin-1-ylheptan-3-amine is sourced from PubChem (CID 79045929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).