N-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine

C16H30N2O — CID 106631554

IUPACN-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine
SMILESCOC1CCCC(N(CC2CCCCN2)C2CC2)C1
InChIInChI=1S/C16H30N2O/c1-19-16-7-4-6-15(11-16)18(14-8-9-14)12-13-5-2-3-10-17-13/h13-17H,2-12H2,1H3
InChIKeyYRVWVRWWCMVPQE-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.55
Rot. Bonds5

About N-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine

N-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine (PubChem CID 106631554) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound NameN-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine
PubChem CID106631554
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine
SMILESCOC1CCCC(N(CC2CCCCN2)C2CC2)C1
InChIInChI=1S/C16H30N2O/c1-19-16-7-4-6-15(11-16)18(14-8-9-14)12-13-5-2-3-10-17-13/h13-17H,2-12H2,1H3
InChIKeyYRVWVRWWCMVPQE-UHFFFAOYSA-N
XLogP2.55
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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-1-ethyl-N-(piperidin-2-ylmethyl)piperidin-4-amine
CID 106621721
N-cyclopropyl-N-(piperidin-2-ylmethyl)-1-propan-2-ylpyrrolidin-3-amine
CID 106621790
(2S)-2-[(3-methoxycyclohexyl)oxymethyl]pyrrolidine
CID 102820167
N-cyclopropyl-2-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 106599133
N-cyclopropyl-N-(piperidin-2-ylmethyl)acetamide
CID 66569474
N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine
CID 106621811
N-(cyclobutylmethyl)-N-(piperidin-2-ylmethyl)cyclopropanamine
CID 106621852
N,N-dimethyl-1-piperidin-2-ylmethanamine;dihydrochloride
CID 45075192
N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]ethanamine
CID 6999827
N-cyclopropyl-N-(piperidin-2-ylmethyl)-1-azabicyclo[3.2.1]octan-4-amine
CID 106621804

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine?
The IUPAC name of N-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine (CID 106631554) is N-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for N-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for N-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine is COC1CCCC(N(CC2CCCCN2)C2CC2)C1.
What is the InChIKey of N-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine?
The InChIKey is YRVWVRWWCMVPQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-19-16-7-4-6-15(11-16)18(14-8-9-14)12-13-5-2-3-10-17-13/h13-17H,2-12H2,1H3.
What are the key properties of N-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine?
N-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine has a molecular weight of 266.43 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-methoxy-N-(piperidin-2-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 106631554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).