N-cyclopentyl-6-[1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine

C16H26N4O — CID 110271695

IUPACN-cyclopentyl-6-[1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine
SMILESCOCCN1CCC1c1cc(NC2CCCC2)nc(C)n1
InChIInChI=1S/C16H26N4O/c1-12-17-14(15-7-8-20(15)9-10-21-2)11-16(18-12)19-13-5-3-4-6-13/h11,13,15H,3-10H2,1-2H3,(H,17,18,19)
InChIKeyRNBRRKLOOABTLF-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.53
Rot. Bonds6

About N-cyclopentyl-6-[1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine

N-cyclopentyl-6-[1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine (PubChem CID 110271695) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-cyclopentyl-6-[1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclopentyl-6-[1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine
PubChem CID110271695
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-cyclopentyl-6-[1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine
SMILESCOCCN1CCC1c1cc(NC2CCCC2)nc(C)n1
InChIInChI=1S/C16H26N4O/c1-12-17-14(15-7-8-20(15)9-10-21-2)11-16(18-12)19-13-5-3-4-6-13/h11,13,15H,3-10H2,1-2H3,(H,17,18,19)
InChIKeyRNBRRKLOOABTLF-UHFFFAOYSA-N
XLogP2.53
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-butyl-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 24992077
4-Ethyl-6-[3-(methylamino)-1-azetidinyl]-2-pyrimidinamine
CID 42623567
4-Isopropyl-6-[3-(methylamino)azetidin-1-yl]pyrimidin-2-amine
CID 42623731
4-ethyl-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 42624149
4-[3-(Ethylamino)azetidin-1-yl]-6-propan-2-ylpyrimidin-2-amine
CID 155513736
4-(3-Aminoazetidin-1-yl)-6-ethylpyrimidin-2-amine
CID 155527319
4-[3-(Dimethylamino)azetidin-1-yl]-6-ethylpyrimidin-2-amine
CID 155528291
4-Ethyl-6-[3-(ethylamino)azetidin-1-yl]pyrimidin-2-amine
CID 155562440
6-ethyl-2-(4-morpholinyl)-N-(3,3,3-trifluoropropyl)-4-pyrimidinamine
CID 39767354
N-{2-[(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)amino]ethyl}acetamide
CID 50973072
N-(tert-butyl)-6-ethyl-2-morpholin-4-ylpyrimidin-4-amine
CID 50977646
rel-(3R,4S)-4-cyclopropyl-1-[6-ethyl-2-(4-morpholinyl)-4-pyrimidinyl]-3-pyrrolidinamine dihydrochloride
CID 72873173

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-[1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine?
The IUPAC name of N-cyclopentyl-6-[1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine (CID 110271695) is N-cyclopentyl-6-[1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine.
What is the SMILES notation for N-cyclopentyl-6-[1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine?
The canonical SMILES for N-cyclopentyl-6-[1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine is COCCN1CCC1c1cc(NC2CCCC2)nc(C)n1.
What is the InChIKey of N-cyclopentyl-6-[1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine?
The InChIKey is RNBRRKLOOABTLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-12-17-14(15-7-8-20(15)9-10-21-2)11-16(18-12)19-13-5-3-4-6-13/h11,13,15H,3-10H2,1-2H3,(H,17,18,19).
What are the key properties of N-cyclopentyl-6-[1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine?
N-cyclopentyl-6-[1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine has a molecular weight of 290.41 g/mol, XLogP of 2.53, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-[1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine is sourced from PubChem (CID 110271695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).