N-(cyclopropylmethyl)pyrido[3,4-d]pyrimidin-4-amine

C11H12N4 — CID 171704170

IUPACN-(cyclopropylmethyl)pyrido[3,4-d]pyrimidin-4-amine
SMILESc1cc2c(NCC3CC3)ncnc2cn1
InChIInChI=1S/C11H12N4/c1-2-8(1)5-13-11-9-3-4-12-6-10(9)14-7-15-11/h3-4,6-8H,1-2,5H2,(H,13,14,15)
InChIKeyUOMZWXWDVWBNGH-UHFFFAOYSA-N
MW200.25 g/mol
LogP1.85
Rot. Bonds3

About N-(cyclopropylmethyl)pyrido[3,4-d]pyrimidin-4-amine

N-(cyclopropylmethyl)pyrido[3,4-d]pyrimidin-4-amine (PubChem CID 171704170) has the molecular formula C11H12N4 and a molecular weight of 200.25 g/mol. Its IUPAC name is N-(cyclopropylmethyl)pyrido[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)pyrido[3,4-d]pyrimidin-4-amine
PubChem CID171704170
Molecular FormulaC11H12N4
Molecular Weight200.25 g/mol
Exact Mass200.11
IUPAC NameN-(cyclopropylmethyl)pyrido[3,4-d]pyrimidin-4-amine
SMILESc1cc2c(NCC3CC3)ncnc2cn1
InChIInChI=1S/C11H12N4/c1-2-8(1)5-13-11-9-3-4-12-6-10(9)14-7-15-11/h3-4,6-8H,1-2,5H2,(H,13,14,15)
InChIKeyUOMZWXWDVWBNGH-UHFFFAOYSA-N
XLogP1.85
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.25
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(quinazolin-4-ylamino)methyl]cyclohexan-1-ol
CID 106130913
N-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 43112087
N-[(3R)-pyrrolidin-3-yl]pyrido[3,4-d]pyrimidin-4-amine
CID 141413091
N-(methylideneamino)pyrido[3,4-d]pyrimidin-4-amine
CID 68597429
1-cyclopropyl-2-(pyrido[3,4-d]pyrimidin-4-ylamino)-1-thiophen-2-ylethanol
CID 138988664
2-propan-2-yl-6-[2-[(pyrido[3,4-d]pyrimidin-4-ylamino)methyl]piperidin-1-yl]pyridazin-3-one
CID 126931249
4-N-(cyclopropylmethyl)pyrido[2,3-d]pyrimidine-4,7-diamine
CID 133408710
4-[3-(fluoromethyl)pyrrolidin-1-yl]pyrido[3,4-d]pyrimidine
CID 163347877
N-[2-(1,1-dioxothian-4-yl)oxyethyl]pyrido[4,3-d]pyrimidin-4-amine
CID 167955633
2-[2-[2-[(pyrido[3,4-d]pyrimidin-4-ylamino)methyl]piperidin-1-yl]ethyl]-7,8-dihydro-5H-pyrano[4,3-c]pyridazin-3-one
CID 126938482
4-N-(cyclopropylmethyl)pyridine-3,4-diamine
CID 28902438
4-iodopyrido[3,4-d]pyrimidine
CID 88934330

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)pyrido[3,4-d]pyrimidin-4-amine?
The IUPAC name of N-(cyclopropylmethyl)pyrido[3,4-d]pyrimidin-4-amine (CID 171704170) is N-(cyclopropylmethyl)pyrido[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for N-(cyclopropylmethyl)pyrido[3,4-d]pyrimidin-4-amine?
The canonical SMILES for N-(cyclopropylmethyl)pyrido[3,4-d]pyrimidin-4-amine is c1cc2c(NCC3CC3)ncnc2cn1.
What is the InChIKey of N-(cyclopropylmethyl)pyrido[3,4-d]pyrimidin-4-amine?
The InChIKey is UOMZWXWDVWBNGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4/c1-2-8(1)5-13-11-9-3-4-12-6-10(9)14-7-15-11/h3-4,6-8H,1-2,5H2,(H,13,14,15).
What are the key properties of N-(cyclopropylmethyl)pyrido[3,4-d]pyrimidin-4-amine?
N-(cyclopropylmethyl)pyrido[3,4-d]pyrimidin-4-amine has a molecular weight of 200.25 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)pyrido[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 171704170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).