N-(furan-3-ylmethyl)-2-methylpropan-2-amine

C9H15NO — CID 10654428

IUPACN-(furan-3-ylmethyl)-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1ccoc1
InChIInChI=1S/C9H15NO/c1-9(2,3)10-6-8-4-5-11-7-8/h4-5,7,10H,6H2,1-3H3
InChIKeyAQHBVQVKVWXNPK-UHFFFAOYSA-N
MW153.22 g/mol
LogP2.17
Rot. Bonds2

About N-(furan-3-ylmethyl)-2-methylpropan-2-amine

N-(furan-3-ylmethyl)-2-methylpropan-2-amine (PubChem CID 10654428) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is N-(furan-3-ylmethyl)-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-(furan-3-ylmethyl)-2-methylpropan-2-amine
PubChem CID10654428
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC NameN-(furan-3-ylmethyl)-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1ccoc1
InChIInChI=1S/C9H15NO/c1-9(2,3)10-6-8-4-5-11-7-8/h4-5,7,10H,6H2,1-3H3
InChIKeyAQHBVQVKVWXNPK-UHFFFAOYSA-N
XLogP2.17
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(furan-3-ylmethyl)-2-methylpropan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(5Z,8Z,11Z,14Z)-N-(3-Furanylmethyl)-5,8,11,14-eicosatetraenamide
CID 10199993
N-Cyclohexyl-3-furanmethanamine
CID 828980
1-(Furan-3-yl)methanamine
CID 2776197
Furan-3-ylmethyl-icosa-5,8,11,14-tetraenyl-amine
CID 11057719
1-(Furan-3-yl)methanamine hydrochloride
CID 2795087
Ethyl((furan-3-yl)methyl)amine
CID 23383580
2-ethoxyethyl (Z)-2-cyano-3-(furan-3-ylmethylamino)but-2-enoate
CID 16127252
1-Cyclopentyl-3-[(furan-3-YL)methyl]-3-methylurea
CID 47349307
1-Cyclohexyl-3-ethyl-1-(furan-3-ylmethyl)urea
CID 71870681
N-[(Furan-3-yl)methyl]icosa-5,8,11,14-tetraenamide
CID 53394011
1-(Furan-3-ylmethyl)-4-methylpiperazine
CID 2173551
1-Ethyl-4-(3-furylmethyl)piperazine
CID 2837943

Frequently Asked Questions

What is the IUPAC name of N-(furan-3-ylmethyl)-2-methylpropan-2-amine?
The IUPAC name of N-(furan-3-ylmethyl)-2-methylpropan-2-amine (CID 10654428) is N-(furan-3-ylmethyl)-2-methylpropan-2-amine.
What is the SMILES notation for N-(furan-3-ylmethyl)-2-methylpropan-2-amine?
The canonical SMILES for N-(furan-3-ylmethyl)-2-methylpropan-2-amine is CC(C)(C)NCc1ccoc1.
What is the InChIKey of N-(furan-3-ylmethyl)-2-methylpropan-2-amine?
The InChIKey is AQHBVQVKVWXNPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-9(2,3)10-6-8-4-5-11-7-8/h4-5,7,10H,6H2,1-3H3.
What are the key properties of N-(furan-3-ylmethyl)-2-methylpropan-2-amine?
N-(furan-3-ylmethyl)-2-methylpropan-2-amine has a molecular weight of 153.22 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-3-ylmethyl)-2-methylpropan-2-amine is sourced from PubChem (CID 10654428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).