5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine

C16H32N2 — CID 83994285

IUPAC5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine
SMILESCC(C)CNC1CC(CC2CC2)CN(C(C)C)C1
InChIInChI=1S/C16H32N2/c1-12(2)9-17-16-8-15(7-14-5-6-14)10-18(11-16)13(3)4/h12-17H,5-11H2,1-4H3
InChIKeyVFSOFULFOGVTBU-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.13
Rot. Bonds6

About 5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine

5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine (PubChem CID 83994285) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine.

Molecular Properties

Compound Name5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine
PubChem CID83994285
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine
SMILESCC(C)CNC1CC(CC2CC2)CN(C(C)C)C1
InChIInChI=1S/C16H32N2/c1-12(2)9-17-16-8-15(7-14-5-6-14)10-18(11-16)13(3)4/h12-17H,5-11H2,1-4H3
InChIKeyVFSOFULFOGVTBU-UHFFFAOYSA-N
XLogP3.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(cyclopropylmethyl)-N-(3-methylbutyl)-1-propan-2-ylpiperidin-3-amine
CID 83995669
5-(cyclopropylmethyl)-N-ethyl-1-propan-2-ylpiperidin-3-amine
CID 83990284
5-(cyclopropylmethyl)-N-(2,2-dimethylpropyl)-1-propan-2-ylpiperidin-3-amine
CID 83994977
N-(2-methylpropyl)-1-propan-2-ylazetidin-3-amine
CID 155088141
1-cyclopropyl-2-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]ethanol
CID 83994301
1-butyl-5-(cyclopropylmethyl)-N-(2-methylpropyl)piperidin-3-amine
CID 83994249
1-[5-(2-methylpropylamino)-1-propan-2-ylpiperidin-3-yl]butan-2-ol
CID 83994299
1-(1-cyclopropylethyl)-5-(cyclopropylmethyl)-N-(3-methylbutyl)piperidin-3-amine
CID 83996007
N-(cyclobutylmethyl)-5-ethyl-1-propan-2-ylpiperidin-3-amine
CID 83997047
N-(cyclopentylmethyl)-5-(cyclopropylmethyl)-1-(2-methylpropyl)piperidin-3-amine
CID 83997691
N-(cyclopentylmethyl)-5-(2,2-dimethylpropyl)-1-propan-2-ylpiperidin-3-amine
CID 83997744
5-(cyclopropylmethyl)-N-(2,2-dimethylpropyl)-1-(2-methylpropyl)piperidin-3-amine
CID 83994925

Frequently Asked Questions

What is the IUPAC name of 5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine?
The IUPAC name of 5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine (CID 83994285) is 5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine.
What is the SMILES notation for 5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine?
The canonical SMILES for 5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine is CC(C)CNC1CC(CC2CC2)CN(C(C)C)C1.
What is the InChIKey of 5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine?
The InChIKey is VFSOFULFOGVTBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-12(2)9-17-16-8-15(7-14-5-6-14)10-18(11-16)13(3)4/h12-17H,5-11H2,1-4H3.
What are the key properties of 5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine?
5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine has a molecular weight of 252.45 g/mol, XLogP of 3.13, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopropylmethyl)-N-(2-methylpropyl)-1-propan-2-ylpiperidin-3-amine is sourced from PubChem (CID 83994285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).