1-amino-2-methyl-5-[2-methylpropyl(pentan-3-yl)amino]pentan-2-ol

C15H34N2O — CID 79490065

IUPAC1-amino-2-methyl-5-[2-methylpropyl(pentan-3-yl)amino]pentan-2-ol
SMILESCCC(CC)N(CCCC(C)(O)CN)CC(C)C
InChIInChI=1S/C15H34N2O/c1-6-14(7-2)17(11-13(3)4)10-8-9-15(5,18)12-16/h13-14,18H,6-12,16H2,1-5H3
InChIKeyHJXIZXZISDJLTR-UHFFFAOYSA-N
MW258.45 g/mol
LogP2.62
Rot. Bonds10

About 1-amino-2-methyl-5-[2-methylpropyl(pentan-3-yl)amino]pentan-2-ol

1-amino-2-methyl-5-[2-methylpropyl(pentan-3-yl)amino]pentan-2-ol (PubChem CID 79490065) has the molecular formula C15H34N2O and a molecular weight of 258.45 g/mol. Its IUPAC name is 1-amino-2-methyl-5-[2-methylpropyl(pentan-3-yl)amino]pentan-2-ol.

Molecular Properties

Compound Name1-amino-2-methyl-5-[2-methylpropyl(pentan-3-yl)amino]pentan-2-ol
PubChem CID79490065
Molecular FormulaC15H34N2O
Molecular Weight258.45 g/mol
Exact Mass258.27
IUPAC Name1-amino-2-methyl-5-[2-methylpropyl(pentan-3-yl)amino]pentan-2-ol
SMILESCCC(CC)N(CCCC(C)(O)CN)CC(C)C
InChIInChI=1S/C15H34N2O/c1-6-14(7-2)17(11-13(3)4)10-8-9-15(5,18)12-16/h13-14,18H,6-12,16H2,1-5H3
InChIKeyHJXIZXZISDJLTR-UHFFFAOYSA-N
XLogP2.62
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.45
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-2-methyl-6-[2-methylpropyl(propan-2-yl)amino]hexan-2-ol
CID 64819799
1-amino-5-[bis(2-methylpropyl)amino]-2-methylpentan-2-ol
CID 64820002
1-amino-2-methyl-5-[methyl(pentan-3-yl)amino]pentan-2-ol
CID 64819989
1-amino-6-[2-methoxyethyl(pentan-3-yl)amino]-2-methylhexan-2-ol
CID 64820477
1-amino-6-[ethyl(propan-2-yl)amino]-2-methylhexan-2-ol
CID 64820439
1-amino-4-[butan-2-yl(butyl)amino]-2-methylbutan-2-ol
CID 64821823
1-amino-5-[cyclopropyl(2-methylpropyl)amino]-2-methylpentan-2-ol
CID 64818670
1-amino-4-[ethyl(2-methylpropyl)amino]-2-methylbutan-2-ol
CID 64820540
2-amino-2-ethyl-5-[2-methylpropyl(pentan-3-yl)amino]pentanenitrile
CID 106803848
1-amino-4-[2-methylpropyl(pentan-3-yl)amino]butan-2-ol
CID 79489819
N,N-bis(2-methylpropyl)pentan-3-amine
CID 20735455
5-N-ethyl-1-N-(2-methylpropyl)-1-N-pentan-3-ylhexane-1,5-diamine
CID 79483858

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-methyl-5-[2-methylpropyl(pentan-3-yl)amino]pentan-2-ol?
The IUPAC name of 1-amino-2-methyl-5-[2-methylpropyl(pentan-3-yl)amino]pentan-2-ol (CID 79490065) is 1-amino-2-methyl-5-[2-methylpropyl(pentan-3-yl)amino]pentan-2-ol.
What is the SMILES notation for 1-amino-2-methyl-5-[2-methylpropyl(pentan-3-yl)amino]pentan-2-ol?
The canonical SMILES for 1-amino-2-methyl-5-[2-methylpropyl(pentan-3-yl)amino]pentan-2-ol is CCC(CC)N(CCCC(C)(O)CN)CC(C)C.
What is the InChIKey of 1-amino-2-methyl-5-[2-methylpropyl(pentan-3-yl)amino]pentan-2-ol?
The InChIKey is HJXIZXZISDJLTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34N2O/c1-6-14(7-2)17(11-13(3)4)10-8-9-15(5,18)12-16/h13-14,18H,6-12,16H2,1-5H3.
What are the key properties of 1-amino-2-methyl-5-[2-methylpropyl(pentan-3-yl)amino]pentan-2-ol?
1-amino-2-methyl-5-[2-methylpropyl(pentan-3-yl)amino]pentan-2-ol has a molecular weight of 258.45 g/mol, XLogP of 2.62, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-methyl-5-[2-methylpropyl(pentan-3-yl)amino]pentan-2-ol is sourced from PubChem (CID 79490065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).