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

C15H32N2O — CID 64791640

IUPAC2-methyl-5-[methyl-[(2-methylcyclopropyl)methyl]amino]-2-(propylamino)pentan-1-ol
SMILESCCCNC(C)(CO)CCCN(C)CC1CC1C
InChIInChI=1S/C15H32N2O/c1-5-8-16-15(3,12-18)7-6-9-17(4)11-14-10-13(14)2/h13-14,16,18H,5-12H2,1-4H3
InChIKeyGZTYKACKJCUXTC-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.11
Rot. Bonds10

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

2-methyl-5-[methyl-[(2-methylcyclopropyl)methyl]amino]-2-(propylamino)pentan-1-ol (PubChem CID 64791640) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 2-methyl-5-[methyl-[(2-methylcyclopropyl)methyl]amino]-2-(propylamino)pentan-1-ol.

Molecular Properties

Compound Name2-methyl-5-[methyl-[(2-methylcyclopropyl)methyl]amino]-2-(propylamino)pentan-1-ol
PubChem CID64791640
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name2-methyl-5-[methyl-[(2-methylcyclopropyl)methyl]amino]-2-(propylamino)pentan-1-ol
SMILESCCCNC(C)(CO)CCCN(C)CC1CC1C
InChIInChI=1S/C15H32N2O/c1-5-8-16-15(3,12-18)7-6-9-17(4)11-14-10-13(14)2/h13-14,16,18H,5-12H2,1-4H3
InChIKeyGZTYKACKJCUXTC-UHFFFAOYSA-N
XLogP2.11
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 ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-[methyl-[(2-methylcyclopropyl)methyl]amino]-2-(propylamino)pentan-1-ol?
The IUPAC name of 2-methyl-5-[methyl-[(2-methylcyclopropyl)methyl]amino]-2-(propylamino)pentan-1-ol (CID 64791640) is 2-methyl-5-[methyl-[(2-methylcyclopropyl)methyl]amino]-2-(propylamino)pentan-1-ol.
What is the SMILES notation for 2-methyl-5-[methyl-[(2-methylcyclopropyl)methyl]amino]-2-(propylamino)pentan-1-ol?
The canonical SMILES for 2-methyl-5-[methyl-[(2-methylcyclopropyl)methyl]amino]-2-(propylamino)pentan-1-ol is CCCNC(C)(CO)CCCN(C)CC1CC1C.
What is the InChIKey of 2-methyl-5-[methyl-[(2-methylcyclopropyl)methyl]amino]-2-(propylamino)pentan-1-ol?
The InChIKey is GZTYKACKJCUXTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-5-8-16-15(3,12-18)7-6-9-17(4)11-14-10-13(14)2/h13-14,16,18H,5-12H2,1-4H3.
What are the key properties of 2-methyl-5-[methyl-[(2-methylcyclopropyl)methyl]amino]-2-(propylamino)pentan-1-ol?
2-methyl-5-[methyl-[(2-methylcyclopropyl)methyl]amino]-2-(propylamino)pentan-1-ol has a molecular weight of 256.43 g/mol, XLogP of 2.11, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[methyl-[(2-methylcyclopropyl)methyl]amino]-2-(propylamino)pentan-1-ol is sourced from PubChem (CID 64791640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).