N-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine

C14H25NO — CID 62998488

IUPACN-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine
SMILESCCCC(CNC(C)(C)C)Cc1ccco1
InChIInChI=1S/C14H25NO/c1-5-7-12(11-15-14(2,3)4)10-13-8-6-9-16-13/h6,8-9,12,15H,5,7,10-11H2,1-4H3
InChIKeySBHUQRPBUVRUAA-UHFFFAOYSA-N
MW223.36 g/mol
LogP3.63
Rot. Bonds6

About N-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine

N-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine (PubChem CID 62998488) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is N-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine.

Molecular Properties

Compound NameN-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine
PubChem CID62998488
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC NameN-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine
SMILESCCCC(CNC(C)(C)C)Cc1ccco1
InChIInChI=1S/C14H25NO/c1-5-7-12(11-15-14(2,3)4)10-13-8-6-9-16-13/h6,8-9,12,15H,5,7,10-11H2,1-4H3
InChIKeySBHUQRPBUVRUAA-UHFFFAOYSA-N
XLogP3.63
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-ethylbutyl)furan
CID 68844643
N-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine
CID 79421182
N-[2-(4-chlorophenyl)-3-(furan-2-yl)propyl]-2-methylpropan-2-amine
CID 79437864
2-(furan-2-ylmethyl)-N-methylbutan-1-amine
CID 62998864
2-[(4-bromophenyl)methyl]-N-tert-butylpentan-1-amine
CID 55195646
N-tert-butyl-2-(furan-2-ylmethoxy)butan-1-amine
CID 62445034
N-[2-(2-bromophenyl)-3-(furan-2-yl)propyl]-2-methylpropan-2-amine
CID 79448849
N-[3-(furan-2-yl)-2-(3-methylphenyl)propyl]-2-methylpropan-2-amine
CID 79416841
2-[(3-bromophenyl)methyl]-N-tert-butylpentan-1-amine
CID 63496756
N-[2-(3-bromophenyl)-3-(furan-2-yl)propyl]-2-methylpropan-2-amine
CID 79442534
2-(furan-2-ylmethyl)butan-1-amine
CID 13029329
N-tert-butyl-2-[(1-methylpyrazol-3-yl)methyl]pentan-1-amine
CID 82870831

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine?
The IUPAC name of N-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine (CID 62998488) is N-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine.
What is the SMILES notation for N-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine?
The canonical SMILES for N-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine is CCCC(CNC(C)(C)C)Cc1ccco1.
What is the InChIKey of N-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine?
The InChIKey is SBHUQRPBUVRUAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-5-7-12(11-15-14(2,3)4)10-13-8-6-9-16-13/h6,8-9,12,15H,5,7,10-11H2,1-4H3.
What are the key properties of N-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine?
N-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine has a molecular weight of 223.36 g/mol, XLogP of 3.63, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine is sourced from PubChem (CID 62998488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).