1-[[methyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde

C11H21NO — CID 62277518

IUPAC1-[[methyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde
SMILESCC(C)N(C)CC1(C=O)CCCC1
InChIInChI=1S/C11H21NO/c1-10(2)12(3)8-11(9-13)6-4-5-7-11/h9-10H,4-8H2,1-3H3
InChIKeyGAWUIPFEZBIXJE-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.09
Rot. Bonds4

About 1-[[methyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde

1-[[methyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde (PubChem CID 62277518) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 1-[[methyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde.

Molecular Properties

Compound Name1-[[methyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde
PubChem CID62277518
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name1-[[methyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde
SMILESCC(C)N(C)CC1(C=O)CCCC1
InChIInChI=1S/C11H21NO/c1-10(2)12(3)8-11(9-13)6-4-5-7-11/h9-10H,4-8H2,1-3H3
InChIKeyGAWUIPFEZBIXJE-UHFFFAOYSA-N
XLogP2.09
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

1-[[2-methylpropyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde
CID 62276078
1-[[2-hydroxypropyl(methyl)amino]methyl]cyclohexane-1-carbaldehyde
CID 62336784
1-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]cyclohexane-1-carbaldehyde
CID 62986108
1-[[cyclopropyl(2-methylpropyl)amino]methyl]cyclopentane-1-carbaldehyde
CID 62276800
N,N-dimethyl-1-[[methyl(propan-2-yl)amino]methyl]cyclobutan-1-amine
CID 176568551
1-[[(1-hydroxycyclopentyl)methyl-methylamino]methyl]cycloheptane-1-carbaldehyde
CID 114953362
1-[[methyl(pentyl)amino]methyl]cyclopentane-1-carbaldehyde
CID 62278291
1-[[methyl(2-methylsulfanylethyl)amino]methyl]cyclopentane-1-carbaldehyde
CID 112664517
N-[[1-(bromomethyl)cyclobutyl]methyl]-N-methylpropan-2-amine
CID 65009190
1-[[1-hydroxypropan-2-yl(methyl)amino]methyl]-4-methylcyclohexane-1-carbaldehyde
CID 104554521
1-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclopentane-1-carbaldehyde
CID 62275706
3-[[methyl(pentan-3-yl)amino]methyl]oxane-3-carbaldehyde
CID 63739908

Frequently Asked Questions

What is the IUPAC name of 1-[[methyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde?
The IUPAC name of 1-[[methyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde (CID 62277518) is 1-[[methyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde.
What is the SMILES notation for 1-[[methyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde?
The canonical SMILES for 1-[[methyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde is CC(C)N(C)CC1(C=O)CCCC1.
What is the InChIKey of 1-[[methyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde?
The InChIKey is GAWUIPFEZBIXJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-10(2)12(3)8-11(9-13)6-4-5-7-11/h9-10H,4-8H2,1-3H3.
What are the key properties of 1-[[methyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde?
1-[[methyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde has a molecular weight of 183.29 g/mol, XLogP of 2.09, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[methyl(propan-2-yl)amino]methyl]cyclopentane-1-carbaldehyde is sourced from PubChem (CID 62277518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).