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

C16H31N3 — CID 106621790

IUPACN-cyclopropyl-N-(piperidin-2-ylmethyl)-1-propan-2-ylpyrrolidin-3-amine
SMILESCC(C)N1CCC(N(CC2CCCCN2)C2CC2)C1
InChIInChI=1S/C16H31N3/c1-13(2)18-10-8-16(12-18)19(15-6-7-15)11-14-5-3-4-9-17-14/h13-17H,3-12H2,1-2H3
InChIKeySMBOZBBUZYYMLU-UHFFFAOYSA-N
MW265.44 g/mol
LogP2.08
Rot. Bonds5

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

N-cyclopropyl-N-(piperidin-2-ylmethyl)-1-propan-2-ylpyrrolidin-3-amine (PubChem CID 106621790) has the molecular formula C16H31N3 and a molecular weight of 265.44 g/mol. Its IUPAC name is N-cyclopropyl-N-(piperidin-2-ylmethyl)-1-propan-2-ylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-(piperidin-2-ylmethyl)-1-propan-2-ylpyrrolidin-3-amine
PubChem CID106621790
Molecular FormulaC16H31N3
Molecular Weight265.44 g/mol
Exact Mass265.25
IUPAC NameN-cyclopropyl-N-(piperidin-2-ylmethyl)-1-propan-2-ylpyrrolidin-3-amine
SMILESCC(C)N1CCC(N(CC2CCCCN2)C2CC2)C1
InChIInChI=1S/C16H31N3/c1-13(2)18-10-8-16(12-18)19(15-6-7-15)11-14-5-3-4-9-17-14/h13-17H,3-12H2,1-2H3
InChIKeySMBOZBBUZYYMLU-UHFFFAOYSA-N
XLogP2.08
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-1-ethyl-N-(piperidin-2-ylmethyl)piperidin-4-amine
CID 106621721
N-cyclopropyl-N-(pyrrolidin-2-ylmethyl)cycloheptanamine
CID 106598991
N-cyclopropyl-3-(2-methylpropyl)-N-(piperidin-2-ylmethyl)cyclohexan-1-amine
CID 107429472
N-cyclopropyl-N-(piperidin-2-ylmethyl)-1-azabicyclo[3.2.1]octan-4-amine
CID 106621804
N-pentan-2-yl-N-(piperidin-2-ylmethyl)cyclopropanamine
CID 106621821
N-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine
CID 106631554
N-cyclopropyl-2-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 106599133
N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine
CID 106621811
N-(2,6-dimethylheptan-4-yl)-N-(piperidin-2-ylmethyl)cyclopropanamine
CID 106621648
1-ethyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylpiperidin-4-amine
CID 106622124
N-cyclopropyl-N-(piperidin-2-ylmethyl)acetamide
CID 66569474
2-[cyclopropyl(piperidin-2-ylmethyl)amino]-1-pyrrolidin-1-ylpropan-1-one
CID 106631682

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(piperidin-2-ylmethyl)-1-propan-2-ylpyrrolidin-3-amine?
The IUPAC name of N-cyclopropyl-N-(piperidin-2-ylmethyl)-1-propan-2-ylpyrrolidin-3-amine (CID 106621790) is N-cyclopropyl-N-(piperidin-2-ylmethyl)-1-propan-2-ylpyrrolidin-3-amine.
What is the SMILES notation for N-cyclopropyl-N-(piperidin-2-ylmethyl)-1-propan-2-ylpyrrolidin-3-amine?
The canonical SMILES for N-cyclopropyl-N-(piperidin-2-ylmethyl)-1-propan-2-ylpyrrolidin-3-amine is CC(C)N1CCC(N(CC2CCCCN2)C2CC2)C1.
What is the InChIKey of N-cyclopropyl-N-(piperidin-2-ylmethyl)-1-propan-2-ylpyrrolidin-3-amine?
The InChIKey is SMBOZBBUZYYMLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3/c1-13(2)18-10-8-16(12-18)19(15-6-7-15)11-14-5-3-4-9-17-14/h13-17H,3-12H2,1-2H3.
What are the key properties of N-cyclopropyl-N-(piperidin-2-ylmethyl)-1-propan-2-ylpyrrolidin-3-amine?
N-cyclopropyl-N-(piperidin-2-ylmethyl)-1-propan-2-ylpyrrolidin-3-amine has a molecular weight of 265.44 g/mol, XLogP of 2.08, 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-2-ylmethyl)-1-propan-2-ylpyrrolidin-3-amine is sourced from PubChem (CID 106621790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).