N,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine

C16H30N2 — CID 83996677

IUPACN,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine
SMILESCCCC1CC(NCC2CC2)CN(CC2CC2)C1
InChIInChI=1S/C16H30N2/c1-2-3-15-8-16(17-9-13-4-5-13)12-18(11-15)10-14-6-7-14/h13-17H,2-12H2,1H3
InChIKeyCNHIGWBJNPIHJQ-UHFFFAOYSA-N
MW250.43 g/mol
LogP2.89
Rot. Bonds7

About N,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine

N,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine (PubChem CID 83996677) has the molecular formula C16H30N2 and a molecular weight of 250.43 g/mol. Its IUPAC name is N,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine.

Molecular Properties

Compound NameN,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine
PubChem CID83996677
Molecular FormulaC16H30N2
Molecular Weight250.43 g/mol
Exact Mass250.24
IUPAC NameN,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine
SMILESCCCC1CC(NCC2CC2)CN(CC2CC2)C1
InChIInChI=1S/C16H30N2/c1-2-3-15-8-16(17-9-13-4-5-13)12-18(11-15)10-14-6-7-14/h13-17H,2-12H2,1H3
InChIKeyCNHIGWBJNPIHJQ-UHFFFAOYSA-N
XLogP2.89
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.43
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclopropylmethyl)-5-propyl-N-(2,2,2-trifluoroethyl)piperidin-3-amine
CID 83992525
N,1,5-tris(cyclopropylmethyl)piperidin-3-amine
CID 83996680
N-(cyclohexylmethyl)-1-ethyl-5-propylpiperidin-3-amine
CID 83998322
methyl N-[1-(cyclopropylmethyl)-5-propylpiperidin-3-yl]carbamate
CID 112543409
N-(cyclobutylmethyl)-1-(cyclopentylmethyl)-5-ethylpiperidin-3-amine
CID 83997430
2-[1-(cyclopropylmethyl)-5-(propylamino)piperidin-3-yl]ethanol
CID 83991207
1-(cyclopropylmethyl)-5-ethyl-N-propylpiperidin-3-amine
CID 83991199
3-[5-(cyclopropylmethylamino)-1-propylpiperidin-3-yl]propan-1-ol
CID 83996295
3-[5-(cyclopropylmethylamino)-1-ethylpiperidin-3-yl]propan-1-ol
CID 83996265
1-[3-(cyclopropylmethylamino)-5-propylpiperidin-1-yl]-2-methylpropan-1-one
CID 83996520
N,5-bis(cyclopropylmethyl)-1-ethylpiperidin-3-amine
CID 83996251
2-[5-(cyclopentylmethylamino)-1-(cyclopropylmethyl)piperidin-3-yl]acetic acid
CID 83998068

Frequently Asked Questions

What is the IUPAC name of N,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine?
The IUPAC name of N,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine (CID 83996677) is N,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine.
What is the SMILES notation for N,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine?
The canonical SMILES for N,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine is CCCC1CC(NCC2CC2)CN(CC2CC2)C1.
What is the InChIKey of N,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine?
The InChIKey is CNHIGWBJNPIHJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2/c1-2-3-15-8-16(17-9-13-4-5-13)12-18(11-15)10-14-6-7-14/h13-17H,2-12H2,1H3.
What are the key properties of N,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine?
N,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine has a molecular weight of 250.43 g/mol, XLogP of 2.89, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-bis(cyclopropylmethyl)-5-propylpiperidin-3-amine is sourced from PubChem (CID 83996677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).