1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine

C16H26N2O — CID 103559792

IUPAC1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine
SMILESCCCNC(Cc1cccnc1)CC1(OC)CCC1
InChIInChI=1S/C16H26N2O/c1-3-9-18-15(11-14-6-4-10-17-13-14)12-16(19-2)7-5-8-16/h4,6,10,13,15,18H,3,5,7-9,11-12H2,1-2H3
InChIKeyCJRBSKURUAUDBK-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.95
Rot. Bonds8

About 1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine

1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine (PubChem CID 103559792) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine.

Molecular Properties

Compound Name1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine
PubChem CID103559792
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine
SMILESCCCNC(Cc1cccnc1)CC1(OC)CCC1
InChIInChI=1S/C16H26N2O/c1-3-9-18-15(11-14-6-4-10-17-13-14)12-16(19-2)7-5-8-16/h4,6,10,13,15,18H,3,5,7-9,11-12H2,1-2H3
InChIKeyCJRBSKURUAUDBK-UHFFFAOYSA-N
XLogP2.95
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-methoxycyclobutyl)-3-(3-methyl-2-pyridinyl)-N-propylpropan-2-amine
CID 103557053
1-(1-methoxycyclobutyl)-3-(1-methylpyrazol-4-yl)-N-propylpropan-2-amine
CID 103559122
1-(3,4-difluorophenyl)-3-(1-methoxycyclobutyl)-N-propylpropan-2-amine
CID 103556973
1-(1-methoxycyclobutyl)-3-(5-methyl-2-pyridinyl)-N-propylpropan-2-amine
CID 103557055
1-(furan-2-yl)-3-(1-methoxycyclobutyl)-N-propylpropan-2-amine
CID 103559757
1-cycloheptyl-N-propyl-3-pyridin-3-ylpropan-2-amine
CID 105034440
N-propyl-1-pyridin-3-yldecan-2-amine
CID 63416378
1-(4-fluorophenyl)-N-propyl-3-pyridin-3-ylpropan-2-amine
CID 62551911
N-[1-(1-methoxy-4-methylcyclohexyl)-2-pyridin-3-ylethyl]propan-1-amine
CID 116766797
1-(2-chloro-6-fluorophenyl)-3-(1-methoxycyclobutyl)-N-propylpropan-2-amine
CID 103556904
N-propyl-1-pyridin-3-yl-4-pyridin-4-ylbutan-2-amine
CID 105179991
5,5,5-trifluoro-N-propyl-1-pyridin-3-ylpentan-2-amine
CID 64565788

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine?
The IUPAC name of 1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine (CID 103559792) is 1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine.
What is the SMILES notation for 1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine?
The canonical SMILES for 1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine is CCCNC(Cc1cccnc1)CC1(OC)CCC1.
What is the InChIKey of 1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine?
The InChIKey is CJRBSKURUAUDBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-9-18-15(11-14-6-4-10-17-13-14)12-16(19-2)7-5-8-16/h4,6,10,13,15,18H,3,5,7-9,11-12H2,1-2H3.
What are the key properties of 1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine?
1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine has a molecular weight of 262.40 g/mol, XLogP of 2.95, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxycyclobutyl)-N-propyl-3-pyridin-3-ylpropan-2-amine is sourced from PubChem (CID 103559792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).