[3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol

C16H32N2O — CID 79655884

IUPAC[3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol
SMILESCCNC1(CO)CCC(N(C)C2CCCCCC2)C1
InChIInChI=1S/C16H32N2O/c1-3-17-16(13-19)11-10-15(12-16)18(2)14-8-6-4-5-7-9-14/h14-15,17,19H,3-13H2,1-2H3
InChIKeyLDKSVTWHYFURJV-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.53
Rot. Bonds5

About [3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol

[3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol (PubChem CID 79655884) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is [3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol
PubChem CID79655884
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name[3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol
SMILESCCNC1(CO)CCC(N(C)C2CCCCCC2)C1
InChIInChI=1S/C16H32N2O/c1-3-17-16(13-19)11-10-15(12-16)18(2)14-8-6-4-5-7-9-14/h14-15,17,19H,3-13H2,1-2H3
InChIKeyLDKSVTWHYFURJV-UHFFFAOYSA-N
XLogP2.53
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(ethylamino)-3-[methyl-(1-methylpiperidin-4-yl)amino]cyclopentyl]methanol
CID 79656682
[1-(ethylamino)-3-[methyl(oxan-4-yl)amino]cyclohexyl]methanol
CID 79641104
[3-[cyclohexyl(methyl)amino]-1-(propylamino)cyclohexyl]methanol
CID 79635204
[1-(ethylamino)-3-[(1-ethylpiperidin-4-yl)-methylamino]cyclohexyl]methanol
CID 79635686
3-[cyclohexyl(methyl)amino]-1-(ethylamino)cyclopentane-1-carboxylic acid
CID 79650504
[1-(ethylamino)-3-[methyl-(2-methyloxolan-3-yl)amino]cyclopentyl]methanol
CID 82744783
[1-(ethylamino)-3-[methyl(2-methylpropyl)amino]cyclopentyl]methanol
CID 79656684
[3-[methyl(oxan-4-yl)amino]-1-(propylamino)cyclopentyl]methanol
CID 79655803
[1-(ethylamino)-3-[methyl(oxan-2-ylmethyl)amino]cyclopentyl]methanol
CID 79657043
[1-(ethylamino)-3-[methyl(pentan-3-yl)amino]cyclohexyl]methanol
CID 79641023
[1-(ethylamino)-3-[methyl(2-pyrrolidin-1-ylethyl)amino]cyclopentyl]methanol
CID 79656265
[1-(ethylamino)-3-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]cyclopentyl]methanol
CID 79644725

Frequently Asked Questions

What is the IUPAC name of [3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol?
The IUPAC name of [3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol (CID 79655884) is [3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol.
What is the SMILES notation for [3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol?
The canonical SMILES for [3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol is CCNC1(CO)CCC(N(C)C2CCCCCC2)C1.
What is the InChIKey of [3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol?
The InChIKey is LDKSVTWHYFURJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-3-17-16(13-19)11-10-15(12-16)18(2)14-8-6-4-5-7-9-14/h14-15,17,19H,3-13H2,1-2H3.
What are the key properties of [3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol?
[3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol has a molecular weight of 268.44 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[cycloheptyl(methyl)amino]-1-(ethylamino)cyclopentyl]methanol is sourced from PubChem (CID 79655884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).