1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine

C17H29NO — CID 105029141

IUPAC1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine
SMILESCCCNC(Cc1ccco1)CC1CCCCCC1
InChIInChI=1S/C17H29NO/c1-2-11-18-16(14-17-10-7-12-19-17)13-15-8-5-3-4-6-9-15/h7,10,12,15-16,18H,2-6,8-9,11,13-14H2,1H3
InChIKeyMGSKZJRTCFCHDL-UHFFFAOYSA-N
MW263.42 g/mol
LogP4.55
Rot. Bonds7

About 1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine

1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine (PubChem CID 105029141) has the molecular formula C17H29NO and a molecular weight of 263.42 g/mol. Its IUPAC name is 1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine.

Molecular Properties

Compound Name1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine
PubChem CID105029141
Molecular FormulaC17H29NO
Molecular Weight263.42 g/mol
Exact Mass263.22
IUPAC Name1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine
SMILESCCCNC(Cc1ccco1)CC1CCCCCC1
InChIInChI=1S/C17H29NO/c1-2-11-18-16(14-17-10-7-12-19-17)13-15-8-5-3-4-6-9-15/h7,10,12,15-16,18H,2-6,8-9,11,13-14H2,1H3
InChIKeyMGSKZJRTCFCHDL-UHFFFAOYSA-N
XLogP4.55
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.42
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(furan-2-yl)-3-methylsulfanyl-N-propylpropan-2-amine
CID 83175814
1-cyclopentyl-N-ethyl-4-(furan-2-yl)butan-2-amine
CID 105138868
1-cyclohexyl-3-(5-ethylthiophen-2-yl)-N-propylpropan-2-amine
CID 115842424
1-cyclopentyl-3-(2,6-dimethylphenyl)-N-propylpropan-2-amine
CID 105024576
1-cyclohexyl-3-(furan-2-yl)-1-methoxy-N-propylpropan-2-amine
CID 116771852
N-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine
CID 103987352
1-cycloheptyl-3-(3-methylphenyl)-N-propylpropan-2-amine
CID 114458153
1-(furan-2-yl)-N-propyldecan-2-amine
CID 105029170
1-cycloheptyl-N-propyl-3-pyridin-3-ylpropan-2-amine
CID 105034440
1-cyclohexyl-N-propylpentan-2-amine
CID 63413972
5,5,5-trifluoro-1-(furan-2-yl)-N-propylpentan-2-amine
CID 83183463
1-cyclopentyl-3-(furan-2-yl)propan-2-amine
CID 105029465

Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine?
The IUPAC name of 1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine (CID 105029141) is 1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine.
What is the SMILES notation for 1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine?
The canonical SMILES for 1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine is CCCNC(Cc1ccco1)CC1CCCCCC1.
What is the InChIKey of 1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine?
The InChIKey is MGSKZJRTCFCHDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29NO/c1-2-11-18-16(14-17-10-7-12-19-17)13-15-8-5-3-4-6-9-15/h7,10,12,15-16,18H,2-6,8-9,11,13-14H2,1H3.
What are the key properties of 1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine?
1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine has a molecular weight of 263.42 g/mol, XLogP of 4.55, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine is sourced from PubChem (CID 105029141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).