N-[2-(3,5-dimethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine

C14H30N2 — CID 62423227

IUPACN-[2-(3,5-dimethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine
SMILESCC(C)CNCC(C)N1CC(C)CC(C)C1
InChIInChI=1S/C14H30N2/c1-11(2)7-15-8-14(5)16-9-12(3)6-13(4)10-16/h11-15H,6-10H2,1-5H3
InChIKeyKQIVXXOYUVNWAL-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.60
Rot. Bonds5

About N-[2-(3,5-dimethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine

N-[2-(3,5-dimethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine (PubChem CID 62423227) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is N-[2-(3,5-dimethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[2-(3,5-dimethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine
PubChem CID62423227
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC NameN-[2-(3,5-dimethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine
SMILESCC(C)CNCC(C)N1CC(C)CC(C)C1
InChIInChI=1S/C14H30N2/c1-11(2)7-15-8-14(5)16-9-12(3)6-13(4)10-16/h11-15H,6-10H2,1-5H3
InChIKeyKQIVXXOYUVNWAL-UHFFFAOYSA-N
XLogP2.60
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 ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,5-dimethylpiperidin-1-yl)-N-prop-2-enylpropan-1-amine
CID 62557815
(2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propan-1-amine
CID 124669022
N-[3-(3,5-dimethylpiperidin-1-yl)butyl]cyclopropanamine
CID 62424497
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine
CID 104960968
N-[2-(3-ethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine
CID 62433783
N-[2-(4-methoxypiperidin-1-yl)propyl]-2-methylpropan-1-amine
CID 62420010
2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine
CID 62773305
CID 175939227
CID 175939227
2-methyl-N-[2-(3-methylpiperidin-1-yl)propyl]butan-1-amine
CID 115887280
N-[2-(4-cyclopentylpiperazin-1-yl)propyl]-2-methylpropan-1-amine
CID 62446554
5-methyl-1-(4-methylpentan-2-yl)piperidin-3-ol
CID 130857038
N-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine
CID 62463018

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,5-dimethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine?
The IUPAC name of N-[2-(3,5-dimethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine (CID 62423227) is N-[2-(3,5-dimethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[2-(3,5-dimethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[2-(3,5-dimethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine is CC(C)CNCC(C)N1CC(C)CC(C)C1.
What is the InChIKey of N-[2-(3,5-dimethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine?
The InChIKey is KQIVXXOYUVNWAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-11(2)7-15-8-14(5)16-9-12(3)6-13(4)10-16/h11-15H,6-10H2,1-5H3.
What are the key properties of N-[2-(3,5-dimethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine?
N-[2-(3,5-dimethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine has a molecular weight of 226.41 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,5-dimethylpiperidin-1-yl)propyl]-2-methylpropan-1-amine is sourced from PubChem (CID 62423227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).