2-(aminomethyl)-4-methyl-2-propan-2-ylpentan-1-ol

C10H23NO — CID 106507553

IUPAC2-(aminomethyl)-4-methyl-2-propan-2-ylpentan-1-ol
SMILESCC(C)CC(CN)(CO)C(C)C
InChIInChI=1S/C10H23NO/c1-8(2)5-10(6-11,7-12)9(3)4/h8-9,12H,5-7,11H2,1-4H3
InChIKeyXYGDTYJLDNPGPW-UHFFFAOYSA-N
MW173.30 g/mol
LogP1.63
Rot. Bonds5

About 2-(aminomethyl)-4-methyl-2-propan-2-ylpentan-1-ol

2-(aminomethyl)-4-methyl-2-propan-2-ylpentan-1-ol (PubChem CID 106507553) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 2-(aminomethyl)-4-methyl-2-propan-2-ylpentan-1-ol.

Molecular Properties

Compound Name2-(aminomethyl)-4-methyl-2-propan-2-ylpentan-1-ol
PubChem CID106507553
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name2-(aminomethyl)-4-methyl-2-propan-2-ylpentan-1-ol
SMILESCC(C)CC(CN)(CO)C(C)C
InChIInChI=1S/C10H23NO/c1-8(2)5-10(6-11,7-12)9(3)4/h8-9,12H,5-7,11H2,1-4H3
InChIKeyXYGDTYJLDNPGPW-UHFFFAOYSA-N
XLogP1.63
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(Aminomethyl)-3,3-dimethylcyclobutyl]methanol
CID 54016362
1-[1-(Aminomethyl)cyclopropyl]-2-methylpropan-1-ol
CID 71758169
2-(Aminomethyl)-3-methylpentan-1-ol
CID 79423352
1-Amino-3,4-dimethyl-hexan-2-ol
CID 44272310
3-Amino-1-cyclobutyl-2,2-dimethylpropan-1-OL
CID 80487110
2-Aminomethyl-2-butylhexane-1-ol
CID 11658412
2-Aminomethyl-2-propylpentane-1-ol
CID 23120774
2-Aminomethyl-2-pentylheptan-1-ol
CID 102474350
3-(Aminomethyl)-3,5,5-trimethylhexan-1-ol
CID 19608967
2-(Aminomethyl)-2-ethylpentan-1-ol
CID 20461811
2-(Aminomethyl)-2-ethylhexan-1-ol
CID 20461812
4-Amino-2-(1-methylcyclopropyl)butan-1-ol
CID 21039911

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-4-methyl-2-propan-2-ylpentan-1-ol?
The IUPAC name of 2-(aminomethyl)-4-methyl-2-propan-2-ylpentan-1-ol (CID 106507553) is 2-(aminomethyl)-4-methyl-2-propan-2-ylpentan-1-ol.
What is the SMILES notation for 2-(aminomethyl)-4-methyl-2-propan-2-ylpentan-1-ol?
The canonical SMILES for 2-(aminomethyl)-4-methyl-2-propan-2-ylpentan-1-ol is CC(C)CC(CN)(CO)C(C)C.
What is the InChIKey of 2-(aminomethyl)-4-methyl-2-propan-2-ylpentan-1-ol?
The InChIKey is XYGDTYJLDNPGPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-8(2)5-10(6-11,7-12)9(3)4/h8-9,12H,5-7,11H2,1-4H3.
What are the key properties of 2-(aminomethyl)-4-methyl-2-propan-2-ylpentan-1-ol?
2-(aminomethyl)-4-methyl-2-propan-2-ylpentan-1-ol has a molecular weight of 173.30 g/mol, XLogP of 1.63, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-4-methyl-2-propan-2-ylpentan-1-ol is sourced from PubChem (CID 106507553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).