2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol

C15H32N2O — CID 62272798

IUPAC2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol
SMILESCCCC(C)(CNC1CC1)CN(CCO)C(C)C
InChIInChI=1S/C15H32N2O/c1-5-8-15(4,11-16-14-6-7-14)12-17(9-10-18)13(2)3/h13-14,16,18H,5-12H2,1-4H3
InChIKeyDCQLFSPPTGQOQM-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.25
Rot. Bonds10

About 2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol

2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol (PubChem CID 62272798) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol.

Molecular Properties

Compound Name2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol
PubChem CID62272798
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol
SMILESCCCC(C)(CNC1CC1)CN(CCO)C(C)C
InChIInChI=1S/C15H32N2O/c1-5-8-15(4,11-16-14-6-7-14)12-17(9-10-18)13(2)3/h13-14,16,18H,5-12H2,1-4H3
InChIKeyDCQLFSPPTGQOQM-UHFFFAOYSA-N
XLogP2.25
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-N',2-dimethyl-N'-propan-2-yl-2-propylpropane-1,3-diamine
CID 62263755
N-cyclopropyl-N'-ethyl-N'-(1-methoxypropan-2-yl)-2-methyl-2-propylpropane-1,3-diamine
CID 55056516
N-cyclopropyl-N',2-dimethyl-N'-(3-methylbutyl)-2-propylpropane-1,3-diamine
CID 55056498
N,N'-dicyclopropyl-N',2-dimethyl-2-propylpropane-1,3-diamine
CID 62262170
1-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-ethylamino]-2-methylpropan-2-ol
CID 79379941
N-cyclopropyl-N'-(cyclopropylmethyl)-2-ethyl-2-methyl-N'-propan-2-ylpropane-1,3-diamine
CID 62260393
2-[[2-(ethylaminomethyl)-2-methylbutyl]-propan-2-ylamino]ethanol
CID 62272801
N-[2-methyl-2-(2-propan-2-yloxyethyl)pentyl]cyclopropanamine
CID 62725819
2-[cyclopropyl-[2-methyl-2-(methylaminomethyl)pentyl]amino]ethanol
CID 62270068
N-[2-methyl-2-[2-(2-methylpropoxy)ethyl]pentyl]cyclopropanamine
CID 106456863
3-[[2-[(cyclopropylamino)methyl]-2-methylbutyl]-ethylamino]propan-1-ol
CID 113469034
N-cyclopropyl-N'-(3,5-dimethylphenyl)-N',2-dimethyl-2-propylpropane-1,3-diamine
CID 63495021

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol?
The IUPAC name of 2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol (CID 62272798) is 2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol.
What is the SMILES notation for 2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol?
The canonical SMILES for 2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol is CCCC(C)(CNC1CC1)CN(CCO)C(C)C.
What is the InChIKey of 2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol?
The InChIKey is DCQLFSPPTGQOQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-5-8-15(4,11-16-14-6-7-14)12-17(9-10-18)13(2)3/h13-14,16,18H,5-12H2,1-4H3.
What are the key properties of 2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol?
2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol has a molecular weight of 256.43 g/mol, XLogP of 2.25, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[(cyclopropylamino)methyl]-2-methylpentyl]-propan-2-ylamino]ethanol is sourced from PubChem (CID 62272798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).