N-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine

C17H19N5O2 — CID 166276030

IUPACN-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine
SMILESCOCCN(Cc1cnc(-c2cncnc2)nc1)Cc1ccco1
InChIInChI=1S/C17H19N5O2/c1-23-6-4-22(12-16-3-2-5-24-16)11-14-7-20-17(21-8-14)15-9-18-13-19-10-15/h2-3,5,7-10,13H,4,6,11-12H2,1H3
InChIKeyMOZUCRDRXONYKK-UHFFFAOYSA-N
MW325.37 g/mol
LogP2.18
Rot. Bonds8

About N-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine

N-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine (PubChem CID 166276030) has the molecular formula C17H19N5O2 and a molecular weight of 325.37 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine
PubChem CID166276030
Molecular FormulaC17H19N5O2
Molecular Weight325.37 g/mol
Exact Mass325.15
IUPAC NameN-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine
SMILESCOCCN(Cc1cnc(-c2cncnc2)nc1)Cc1ccco1
InChIInChI=1S/C17H19N5O2/c1-23-6-4-22(12-16-3-2-5-24-16)11-14-7-20-17(21-8-14)15-9-18-13-19-10-15/h2-3,5,7-10,13H,4,6,11-12H2,1H3
InChIKeyMOZUCRDRXONYKK-UHFFFAOYSA-N
XLogP2.18
TPSA77.17 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze N-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine with MolForge

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Related Compounds

N-[[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-N-(furan-2-ylmethyl)-2-methoxyethanamine
CID 52601883
N-[(2-ethylsulfanylpyrimidin-5-yl)methyl]-N-(furan-2-ylmethyl)butan-1-amine
CID 46983650
N-(furan-2-ylmethyl)-N-(2-methoxyethyl)cyclopropanamine
CID 47023472
N-[[3-(1-ethoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]-N-(furan-2-ylmethyl)-2-methoxyethanamine
CID 56806430
N-[(5-chloro-1-methylbenzimidazol-2-yl)methyl]-N-(furan-2-ylmethyl)-2-methoxyethanamine
CID 60509766
4-[5-[[furan-2-ylmethyl(2-methoxyethyl)amino]methyl]furan-2-yl]hepta-1,6-dien-4-ol
CID 24714559
5-[furan-2-ylmethyl(2-methoxyethyl)carbamoyl]pyrazine-2-carboxylic acid
CID 120685085
N-(furan-2-ylmethyl)-5-iodo-N-methylpyrimidin-4-amine
CID 65418233
1-[furan-2-ylmethyl(2-methoxyethyl)amino]-3-prop-2-enoxypropan-2-ol
CID 24713625
N,N-bis(furan-2-ylmethyl)-1-phenylmethanamine
CID 10825735
1-[benzyl(2-methoxyethyl)amino]-3-(furan-2-ylmethoxy)propan-2-ol
CID 42682208
(2S)-1-[benzyl(2-methoxyethyl)amino]-3-(furan-2-ylmethoxy)propan-2-ol
CID 93146968

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine?
The IUPAC name of N-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine (CID 166276030) is N-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine?
The canonical SMILES for N-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine is COCCN(Cc1cnc(-c2cncnc2)nc1)Cc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine?
The InChIKey is MOZUCRDRXONYKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O2/c1-23-6-4-22(12-16-3-2-5-24-16)11-14-7-20-17(21-8-14)15-9-18-13-19-10-15/h2-3,5,7-10,13H,4,6,11-12H2,1H3.
What are the key properties of N-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine?
N-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine has a molecular weight of 325.37 g/mol, XLogP of 2.18, 8 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-methoxy-N-[(2-pyrimidin-5-ylpyrimidin-5-yl)methyl]ethanamine is sourced from PubChem (CID 166276030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).