N-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine

C17H33N3 — CID 106624960

IUPACN-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine
SMILESCC(C)N1CCC(N(CC2CCCNC2)C2CC2)CC1
InChIInChI=1S/C17H33N3/c1-14(2)19-10-7-17(8-11-19)20(16-5-6-16)13-15-4-3-9-18-12-15/h14-18H,3-13H2,1-2H3
InChIKeyCCEFRBSRCCCMQR-UHFFFAOYSA-N
MW279.47 g/mol
LogP2.32
Rot. Bonds5

About N-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine

N-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine (PubChem CID 106624960) has the molecular formula C17H33N3 and a molecular weight of 279.47 g/mol. Its IUPAC name is N-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine
PubChem CID106624960
Molecular FormulaC17H33N3
Molecular Weight279.47 g/mol
Exact Mass279.27
IUPAC NameN-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine
SMILESCC(C)N1CCC(N(CC2CCCNC2)C2CC2)CC1
InChIInChI=1S/C17H33N3/c1-14(2)19-10-7-17(8-11-19)20(16-5-6-16)13-15-4-3-9-18-12-15/h14-18H,3-13H2,1-2H3
InChIKeyCCEFRBSRCCCMQR-UHFFFAOYSA-N
XLogP2.32
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.47
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine
CID 106624585
N-cyclopropyl-N-(piperidin-3-ylmethyl)spiro[4.5]decan-8-amine
CID 106624955
N-cyclopropyl-1,1-dioxo-N-(piperidin-3-ylmethyl)thiolan-3-amine
CID 104870090
N-methyl-N-piperidin-3-yl-1-propan-2-ylazepan-4-amine
CID 65077288
N-ethyl-1-propan-2-yl-N-pyrrolidin-3-ylazepan-4-amine
CID 65077931
4-[cyclopropyl(piperidin-3-ylmethyl)amino]azepan-2-one
CID 106639774
N-cyclopropyl-2,5-dimethyl-N-(piperidin-3-ylmethyl)cyclohexan-1-amine
CID 106624758
4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine
CID 106624301
N-ethyl-N-(piperidin-3-ylmethyl)-4-propan-2-ylcyclohexan-1-amine
CID 106624491
N-(cycloheptylmethyl)-N-(piperidin-3-ylmethyl)propan-2-amine
CID 106624258
N-(azetidin-3-yl)-N-ethyl-1-propan-2-ylazepan-4-amine
CID 66181851
N-(cycloheptylmethyl)-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106625038

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine?
The IUPAC name of N-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine (CID 106624960) is N-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine.
What is the SMILES notation for N-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine?
The canonical SMILES for N-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine is CC(C)N1CCC(N(CC2CCCNC2)C2CC2)CC1.
What is the InChIKey of N-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine?
The InChIKey is CCEFRBSRCCCMQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3/c1-14(2)19-10-7-17(8-11-19)20(16-5-6-16)13-15-4-3-9-18-12-15/h14-18H,3-13H2,1-2H3.
What are the key properties of N-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine?
N-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine has a molecular weight of 279.47 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(piperidin-3-ylmethyl)-1-propan-2-ylpiperidin-4-amine is sourced from PubChem (CID 106624960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).