2-methoxy-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine

C15H30N2O — CID 43768293

IUPAC2-methoxy-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine
SMILESCOC1CCCCC1NCCCN1CCCCC1
InChIInChI=1S/C15H30N2O/c1-18-15-9-4-3-8-14(15)16-10-7-13-17-11-5-2-6-12-17/h14-16H,2-13H2,1H3
InChIKeyACVRTRGORULSQW-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.41
Rot. Bonds6

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

2-methoxy-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine (PubChem CID 43768293) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-methoxy-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine
PubChem CID43768293
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-methoxy-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine
SMILESCOC1CCCCC1NCCCN1CCCCC1
InChIInChI=1S/C15H30N2O/c1-18-15-9-4-3-8-14(15)16-10-7-13-17-11-5-2-6-12-17/h14-16H,2-13H2,1H3
InChIKeyACVRTRGORULSQW-UHFFFAOYSA-N
XLogP2.41
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-N-methyl-2-N-(3-pyrrolidin-1-ylpropyl)cyclohexane-1,2-diamine
CID 175787085
2-(3-pyrrolidin-1-ylpropylamino)cycloheptan-1-ol
CID 55141909
N-(3-cyclohexyloxypropyl)-2-methoxycyclohexan-1-amine
CID 43770852
2-methoxy-N-[2-(1-methylpiperidin-2-yl)ethyl]cyclopentan-1-amine
CID 55067119
2-methyl-N-(3-piperidin-1-ylpropyl)thian-3-amine
CID 79956996
2-methoxy-N-(3-propan-2-yloxypropyl)cyclohexan-1-amine
CID 43771411
2-methylsulfonyl-N-(3-pyrrolidin-1-ylpropyl)cyclopentan-1-amine
CID 65046605
N-[3-(3-methoxy-4-methylpiperidin-1-yl)propyl]cyclopentanamine
CID 102968310
2,6-dimethyl-N-(3-pyrrolidin-1-ylpropyl)cyclohexan-1-amine
CID 43181783
trans-(1S,2S)-N-ethyl-2-methoxycyclohexan-1-amine
CID 93280859
N'-(2-methoxycyclopentyl)-N-prop-2-ynylethane-1,2-diamine
CID 79270926
3-methyl-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine
CID 43181773

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine?
The IUPAC name of 2-methoxy-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine (CID 43768293) is 2-methoxy-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine.
What is the SMILES notation for 2-methoxy-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine?
The canonical SMILES for 2-methoxy-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine is COC1CCCCC1NCCCN1CCCCC1.
What is the InChIKey of 2-methoxy-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine?
The InChIKey is ACVRTRGORULSQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-18-15-9-4-3-8-14(15)16-10-7-13-17-11-5-2-6-12-17/h14-16H,2-13H2,1H3.
What are the key properties of 2-methoxy-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine?
2-methoxy-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine has a molecular weight of 254.42 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(3-piperidin-1-ylpropyl)cyclohexan-1-amine is sourced from PubChem (CID 43768293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).