N-(furan-3-ylmethyl)adamantan-1-amine

C15H21NO — CID 44553390

IUPACN-(furan-3-ylmethyl)adamantan-1-amine
SMILESc1cc(CNC23CC4CC(CC(C4)C2)C3)co1
InChIInChI=1S/C15H21NO/c1-2-17-10-11(1)9-16-15-6-12-3-13(7-15)5-14(4-12)8-15/h1-2,10,12-14,16H,3-9H2
InChIKeyWCDZSUJEEOWDHM-UHFFFAOYSA-N
MW231.34 g/mol
LogP3.34
Rot. Bonds3

About N-(furan-3-ylmethyl)adamantan-1-amine

N-(furan-3-ylmethyl)adamantan-1-amine (PubChem CID 44553390) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is N-(furan-3-ylmethyl)adamantan-1-amine.

Molecular Properties

Compound NameN-(furan-3-ylmethyl)adamantan-1-amine
PubChem CID44553390
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC NameN-(furan-3-ylmethyl)adamantan-1-amine
SMILESc1cc(CNC23CC4CC(CC(C4)C2)C3)co1
InChIInChI=1S/C15H21NO/c1-2-17-10-11(1)9-16-15-6-12-3-13(7-15)5-14(4-12)8-15/h1-2,10,12-14,16H,3-9H2
InChIKeyWCDZSUJEEOWDHM-UHFFFAOYSA-N
XLogP3.34
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-Cyclohexyl-3-furanmethanamine
CID 828980
(1S,2R,3R,5R)-N-(furan-3-ylmethyl)-2,6,6-trimethylbicyclo[3.1.1]heptan-3-amine
CID 145952246
1-(Adamantan-1-yl)-3-{[1-(furan-3-carbonyl)piperidin-4-yl]methyl}urea
CID 71786821
1-(Adamantan-1-yl)-3-[(furan-3-yl)methyl]-3-(2-methoxyethyl)urea
CID 71804046
N-(adamantan-1-yl)furan-3-carboxamide
CID 16389130
N-(furan-3-ylmethyl)-3-(trifluoromethyl)cyclohexan-1-amine
CID 63001241
N-(furan-3-ylmethyl)-2-(trifluoromethyl)cyclohexan-1-amine
CID 63001355
N-(furan-3-ylmethyl)-4-(trifluoromethyl)cyclohexan-1-amine
CID 63001676
1-(aminomethyl)-N-(furan-3-ylmethyl)-N-methyl-3-(trifluoromethyl)cyclohexan-1-amine
CID 64758012
(1R*,5S*,6r)-N-1-adamantyl-3-(3-furylmethyl)-3-azabicyclo[3.1.0]hexane-6-carboxamide
CID 56914354
N-(furan-3-ylmethyl)adamantan-2-amine
CID 44554070
N-(3-furylmethyl)cyclohexanamine hydrochloride
CID 45074815

Frequently Asked Questions

What is the IUPAC name of N-(furan-3-ylmethyl)adamantan-1-amine?
The IUPAC name of N-(furan-3-ylmethyl)adamantan-1-amine (CID 44553390) is N-(furan-3-ylmethyl)adamantan-1-amine.
What is the SMILES notation for N-(furan-3-ylmethyl)adamantan-1-amine?
The canonical SMILES for N-(furan-3-ylmethyl)adamantan-1-amine is c1cc(CNC23CC4CC(CC(C4)C2)C3)co1.
What is the InChIKey of N-(furan-3-ylmethyl)adamantan-1-amine?
The InChIKey is WCDZSUJEEOWDHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-2-17-10-11(1)9-16-15-6-12-3-13(7-15)5-14(4-12)8-15/h1-2,10,12-14,16H,3-9H2.
What are the key properties of N-(furan-3-ylmethyl)adamantan-1-amine?
N-(furan-3-ylmethyl)adamantan-1-amine has a molecular weight of 231.34 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-3-ylmethyl)adamantan-1-amine is sourced from PubChem (CID 44553390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).