5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol

C16H34N2O — CID 64787636

IUPAC5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol
SMILESCCCNC(C)(CO)CCCN(C)CC1CCCC1
InChIInChI=1S/C16H34N2O/c1-4-11-17-16(2,14-19)10-7-12-18(3)13-15-8-5-6-9-15/h15,17,19H,4-14H2,1-3H3
InChIKeyNDKQNWFAALJLGP-UHFFFAOYSA-N
MW270.46 g/mol
LogP2.64
Rot. Bonds10

About 5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol

5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol (PubChem CID 64787636) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is 5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol.

Molecular Properties

Compound Name5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol
PubChem CID64787636
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Name5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol
SMILESCCCNC(C)(CO)CCCN(C)CC1CCCC1
InChIInChI=1S/C16H34N2O/c1-4-11-17-16(2,14-19)10-7-12-18(3)13-15-8-5-6-9-15/h15,17,19H,4-14H2,1-3H3
InChIKeyNDKQNWFAALJLGP-UHFFFAOYSA-N
XLogP2.64
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-5-[methyl(oxan-3-ylmethyl)amino]-2-(propylamino)pentan-1-ol
CID 64791814
5-[cyclopentylmethyl(methyl)amino]-2-ethyl-2-(propylamino)pentan-1-ol
CID 106808716
2-methyl-5-[methyl-[(2-methylcyclopropyl)methyl]amino]-2-(propylamino)pentan-1-ol
CID 64791640
3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64826426
4-[cyclopentylmethyl(methyl)amino]-2-(ethylamino)-2-methylbutan-1-ol
CID 64787817
5-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methyl-2-(propylamino)pentan-1-ol
CID 79312291
3-[cyclopropylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64825469
6-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)-2-methylhexan-1-ol
CID 64786465
2-methyl-5-[methyl(2-pyrrolidin-1-ylethyl)amino]-2-(propylamino)pentan-1-ol
CID 64791065
2-methyl-5-[methyl(2-methylpropyl)amino]-2-(propylamino)pentan-1-ol
CID 64796336
2-(ethylamino)-2-methyl-5-[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]pentan-1-ol
CID 64788799
6-[2,2-dimethylpropyl(methyl)amino]-2-methyl-2-(propylamino)hexan-1-ol
CID 64825383

Frequently Asked Questions

What is the IUPAC name of 5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol?
The IUPAC name of 5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol (CID 64787636) is 5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol.
What is the SMILES notation for 5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol?
The canonical SMILES for 5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol is CCCNC(C)(CO)CCCN(C)CC1CCCC1.
What is the InChIKey of 5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol?
The InChIKey is NDKQNWFAALJLGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-4-11-17-16(2,14-19)10-7-12-18(3)13-15-8-5-6-9-15/h15,17,19H,4-14H2,1-3H3.
What are the key properties of 5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol?
5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol has a molecular weight of 270.46 g/mol, XLogP of 2.64, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol is sourced from PubChem (CID 64787636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).