[2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol

C17H34N2O — CID 79571345

IUPAC[2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
SMILESCC(C)NC1(CO)CCCC1CCN(C)CC1CC1C
InChIInChI=1S/C17H34N2O/c1-13(2)18-17(12-20)8-5-6-16(17)7-9-19(4)11-15-10-14(15)3/h13-16,18,20H,5-12H2,1-4H3
InChIKeyIKMSVMBPYNJNDP-UHFFFAOYSA-N
MW282.47 g/mol
LogP2.49
Rot. Bonds8

About [2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol

[2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol (PubChem CID 79571345) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is [2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
PubChem CID79571345
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name[2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
SMILESCC(C)NC1(CO)CCCC1CCN(C)CC1CC1C
InChIInChI=1S/C17H34N2O/c1-13(2)18-17(12-20)8-5-6-16(17)7-9-19(4)11-15-10-14(15)3/h13-16,18,20H,5-12H2,1-4H3
InChIKeyIKMSVMBPYNJNDP-UHFFFAOYSA-N
XLogP2.49
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[2-[methyl(2-methylbutyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79571377
[2-[2-[3-methoxypropyl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79571919
[2-[2-[cyclopropylmethyl(propan-2-yl)amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79567218
[2-[2-[butyl(cyclopropyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79567491
[2-[2-[cyclopentyl(ethyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79566933
[2-[2-(4-methylpiperidin-1-yl)ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79571574
[2-(2-methoxyethyl)-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79581006
[2-[2-(4-methylcyclohexyl)oxyethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79586748
[2-[2-(3-methylpyrrolidin-1-yl)ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79571310
[2-[2-[methyl(2-methylpropyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79571507
[1-(methylamino)-2-[2-[methyl(oxan-4-ylmethyl)amino]ethyl]cyclopentyl]methanol
CID 79571129
[2-(2-ethylsulfanylethyl)-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79582041

Frequently Asked Questions

What is the IUPAC name of [2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol?
The IUPAC name of [2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol (CID 79571345) is [2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol.
What is the SMILES notation for [2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol?
The canonical SMILES for [2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol is CC(C)NC1(CO)CCCC1CCN(C)CC1CC1C.
What is the InChIKey of [2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol?
The InChIKey is IKMSVMBPYNJNDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-13(2)18-17(12-20)8-5-6-16(17)7-9-19(4)11-15-10-14(15)3/h13-16,18,20H,5-12H2,1-4H3.
What are the key properties of [2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol?
[2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol has a molecular weight of 282.47 g/mol, XLogP of 2.49, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol is sourced from PubChem (CID 79571345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).