N-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine

C15H25N3O — CID 106128059

IUPACN-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine
SMILESCC(C)Oc1cccnc1NCC1CCCC(N)C1
InChIInChI=1S/C15H25N3O/c1-11(2)19-14-7-4-8-17-15(14)18-10-12-5-3-6-13(16)9-12/h4,7-8,11-13H,3,5-6,9-10,16H2,1-2H3,(H,17,18)
InChIKeyCQLGRVJPMWBGPU-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.80
Rot. Bonds5

About N-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine

N-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine (PubChem CID 106128059) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine.

Molecular Properties

Compound NameN-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine
PubChem CID106128059
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine
SMILESCC(C)Oc1cccnc1NCC1CCCC(N)C1
InChIInChI=1S/C15H25N3O/c1-11(2)19-14-7-4-8-17-15(14)18-10-12-5-3-6-13(16)9-12/h4,7-8,11-13H,3,5-6,9-10,16H2,1-2H3,(H,17,18)
InChIKeyCQLGRVJPMWBGPU-UHFFFAOYSA-N
XLogP2.80
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylcyclopentyl)-3-propan-2-yloxypyridin-2-amine
CID 112568510
N-(3-methyl-2-propan-2-ylbutyl)-3-propan-2-yloxypyridin-2-amine
CID 102914136
3-propan-2-yloxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine
CID 113450392
1-N-(cyclobutylmethyl)-3-propan-2-yloxybenzene-1,2-diamine
CID 113393307
1-N-(3-propan-2-yloxy-2-pyridinyl)pentane-1,4-diamine
CID 106127389
N-[2-(chloromethyl)cyclopentyl]-3-propan-2-yloxypyridin-2-amine
CID 106365544
N-(cyclohexylmethyl)-3-methylpyridin-2-amine
CID 60960481
N-[(3-aminocyclopentyl)methyl]-4-propan-2-yloxypyrimidin-2-amine
CID 106126729
N-[(2-aminocyclopentyl)methyl]-3-propoxypyridin-2-amine
CID 113371376
N-[(3-aminocyclohexyl)methyl]thieno[3,2-c]pyridin-4-amine
CID 106128217
N-[(4-ethylphenyl)methyl]-3-propan-2-yloxypyridin-2-amine
CID 106900068
3-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)pyridin-2-amine
CID 114169605

Frequently Asked Questions

What is the IUPAC name of N-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine?
The IUPAC name of N-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine (CID 106128059) is N-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine.
What is the SMILES notation for N-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine?
The canonical SMILES for N-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine is CC(C)Oc1cccnc1NCC1CCCC(N)C1.
What is the InChIKey of N-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine?
The InChIKey is CQLGRVJPMWBGPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-11(2)19-14-7-4-8-17-15(14)18-10-12-5-3-6-13(16)9-12/h4,7-8,11-13H,3,5-6,9-10,16H2,1-2H3,(H,17,18).
What are the key properties of N-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine?
N-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine has a molecular weight of 263.38 g/mol, XLogP of 2.80, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-aminocyclohexyl)methyl]-3-propan-2-yloxypyridin-2-amine is sourced from PubChem (CID 106128059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).